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Using CC(O)c1cc(Cl)cc(-c2ccc(C#N)cc2)c1, BrC(Br)(Br)Br to produce CC(Br)c1cc(Cl)cc(-c2ccc(C#N)cc2)c1, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["C1CCOC1", "CCCCC"], "agent": ["c1ccc(P(c2ccccc2)c2ccccc2)cc1"]} |
Using O=C1NC(=O)[C@@H]2CC=CC[C@H]12 to produce O=C1NC(=O)[C@@H]2CCCC[C@H]12, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["CCO"], "agent": ["[Pd]"]} |
Using CCOC(=O)CBr, C[C@@H]1CNC[C@H](C)O1 to produce CCOC(=O)CN1C[C@@H](C)O[C@@H](C)C1, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["CC#N"], "agent": ["O=C([O-])[O-]", "[K+]"]} |
Using [O-]B([O-])Oc1ccc(F)cc1, O=C(C=Cc1cccc(Br)c1)Nc1ccc(CN2CCCCC2)cc1 to produce O=C(C=Cc1cccc(-c2ccc(F)cc2)c1)Nc1ccc(CN2CCCCC2)cc1, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["CCO", "Cc1ccccc1"], "agent": ["O=C([O-])[O-]", "[K+]", "c1ccc([P](c2ccccc2)(c2ccccc2)[Pd]([P](c2ccccc2)(c2ccccc2)c2ccccc2)([P](c2ccccc2)(c2ccccc2)c2ccccc2)[P](c2ccccc2)(c2ccccc2)c2ccccc2)cc1"]} |
Using CCOCC, C=CC1(CC=O)CCN(Cc2ccccc2)CC1 to produce C=CC1(CC(=O)OC)CCN(Cc2ccccc2)CC1, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["CN(C)C=O", "CO"], "agent": ["c1cc[nH+]cc1", "O=[Cr](=O)([O-])O[Cr](=O)(=O)[O-]"]} |
Using CC[C@@H]1C[C@H](N(C#N)Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)CN1C(=O)OC(C)(C)C, [N-]=[N+]=[N-] to produce CC[C@@H]1C[C@H](N(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c2nn[nH]n2)CN1C(=O)OC(C)(C)C, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["CN(C)C=O", "O"], "agent": ["[Na+]"]} |
Using CCCC1=CCC(C(=O)NC(C(C)Cl)C2OC(SC)C(O)C(O)C2O)NCC1 to produce CCCC1CCNC(C(=O)NC(C(C)Cl)C2OC(SC)C(O)C(O)C2O)CC1, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["CO"], "agent": ["[Pd]"]} |
Using C=C(C)C(=O)O, CCC1=CCCCC1 to produce C=C(C)C(=O)OC1(CC)CCCCC1, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["Cc1ccccc1"], "agent": ["O=S(=O)(O)O", "[Na+]", "[OH-]"]} |
Using CCOC(=O)c1cc2cc(OC3CCN(C(C)C)CC3)cnc2n1C(=O)OC(C)(C)C to produce CC(C)N1CCC(Oc2cnc3[nH]c(C(=O)O)cc3c2)CC1, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["C1COCCO1"], "agent": ["Cl"]} |
Using [N-]=[N+]=[N-], CCOC(=O)C(C#N)=CNc1ncccc1C to produce Cc1cccn2c(=O)c(-c3nnn[nH]3)cnc12, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["C1CCOC1"], "agent": ["[Al+3]", "[Cl-]", "[Na+]"]} |
Using O=c1ccsn1-c1ccc(CBr)cc1, [N-]=[N+]=[N-] to produce [N-]=[N+]=NCc1ccc(-n2sccc2=O)cc1, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["CN(C)C=O", "O"], "agent": ["[Na+]"]} |
Using NC(=O)c1c(N)cccc1-c1ccccc1, CC1(C)OCC(C)(C(=O)O)CO1 to produce CC1(C)OCC(C)(C(=O)Nc2cccc(-c3ccccc3)c2C(N)=O)CO1, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["ClCCl", "CCN(C(C)C)C(C)C"], "agent": ["F[P-](F)(F)(F)(F)F", "CN(C)C(On1nnc2cccnc21)=[N+](C)C"]} |
Using COC(=O)C(C)n1ncnn1, Fc1cc(Br)ccc1OC(F)(F)F to produce CCOC(=O)C(C)n1ncnn1, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["O", "C1CCOC1"], "agent": ["[Mg]", "Cl", "II"]} |
Using Cc1ccc(S(=O)(=O)Cl)cc1, CCC(CCO)C(F)(F)F to produce CCC(CCOS(=O)(=O)c1ccc(C)cc1)C(F)(F)F, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["CCN(CC)CC", "C1CCOC1"], "agent": ["Cl"]} |
Using CI, Cc1sc(NC(=S)NC(=O)c2ccccc2)c(C#N)c1C to produce CSc1nc(N)c2c(C)c(C)sc2n1, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["CCO"], "agent": ["[Na+]", "[OH-]"]} |
Using COC(CNCCCN1CCCCC1)OC, CC(Nc1ccc(Cl)c(Cl)c1)C(=O)O to produce COC(CN(CCCN1CCCCC1)C(=O)C(C)Nc1ccc(Cl)c(Cl)c1)OC, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["CN(C)C=O", "CN1CCOCC1"], "agent": ["F[P-](F)(F)(F)(F)F", "CN(C)C(On1nnc2cccnc21)=[N+](C)C"]} |
Using OB(O)c1ccc(O)cc1, COC(=O)c1ccc(OCc2ccccc2)c(Br)c1 to produce COC(=O)c1ccc(OCc2ccccc2)c(-c2ccc(O)cc2)c1, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["Cc1ccccc1", "CO"], "agent": ["O=C([O-])[O-]", "[Cs+]", "c1ccc([P](c2ccccc2)(c2ccccc2)[Pd]([P](c2ccccc2)(c2ccccc2)c2ccccc2)([P](c2ccccc2)(c2ccccc2)c2ccccc2)[P](c2ccccc2)(c2ccccc2)c2ccccc2)cc1"]} |
Using Fc1c(Cl)ncnc1Cl, CC(C)(C)[Si](C)(C)OC[C@@H]1C[C@@H](O)C[C@@H]1O[Si](C)(C)C(C)(C)C to produce CC(C)(C)[Si](C)(C)OC[C@@H]1C[C@@H](Oc2ncnc(Cl)c2F)C[C@@H]1O[Si](C)(C)C(C)(C)C, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["C1CCOC1"], "agent": ["[Na+]", "[H-]"]} |
Using OB(O)c1cccc(F)c1, CC1CN(C(=O)OC(C)(C)C)Cc2scc(Br)c2O1 to produce CC1CN(C(=O)OC(C)(C)C)Cc2scc(-c3cccc(F)c3)c2O1, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["O", "COCCOC"], "agent": ["O=C([O-])[O-]", "[K+]", "Cl[Pd](Cl)([P](c1ccccc1)(c1ccccc1)c1ccccc1)[P](c1ccccc1)(c1ccccc1)c1ccccc1"]} |
Using COC(=O)C(C)c1ccc2ncsc2c1 to produce CC(C(=O)O)c1ccc2ncsc2c1, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["CCOC(C)=O"], "agent": ["[Na+]", "[OH-]"]} |
Using CC[C@@H](NC(=O)OC(C)(C)C)c1ccc(Cl)c(C(=O)c2ccc(C(N)=O)nc2)c1F to produce CC[C@@H](N)c1ccc(Cl)c(C(=O)c2ccc(C(N)=O)nc2)c1F, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["CCOC(C)=O"], "agent": ["Cl"]} |
Using CCOC(=O)c1c(S(N)=O)c2cc(Cl)ccc2n1C, O=[Mn](=O)(=O)[O-] to produce Cn1c2c(c3cc(Cl)ccc31)S(=O)(=O)NC2=O, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["O", "CC(C)=O"], "agent": ["[K+]"]} |
Using CCOc1ccc2c(c1)[C@]1(C)CCN(C)[C@@H]1N2C, O=[N+]=O to produce CCOc1cc([N+](=O)[O-])c2c(c1)[C@]1(C)CCN(C)[C@@H]1N2C, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["ClC(Cl)Cl"], "agent": ["F[B-](F)(F)F"]} |
Using COc1ccnc(-c2ccc(Cl)c([N+](=O)[O-])c2)c1 to produce COc1ccnc(-c2ccc(Cl)c(N)c2)c1, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["O", "CCO"], "agent": ["[Fe]", "[Cl-]", "[NH4+]"]} |
Using CC(=O)O, CC[C@H](OC(C)=O)[C@@H]1C[C@H]2OC(C)(C)O[C@H]2O1 to produce CC[C@H](OC(C)=O)[C@@H]1C[C@@H](OC(C)=O)C(OC(C)=O)O1, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["CC(=O)OC(C)=O", "ClCCl"], "agent": ["O=S(=O)(O)O"]} |
Using COc1cccc(CBr)n1, CCOC(=O)CN=C(c1ccccc1)c1ccccc1 to produce CCOC(=O)[C@H](Cc1cccc(OC)n1)N=C(c1ccccc1)c1ccccc1, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["O", "C1CCOC1"], "agent": ["[Na+]", "[OH-]"]} |
Using CN1CCN(c2cc(NCC3CCCCC3)c([N+](=O)[O-])cc2Nc2ccccc2)CC1 to produce CN1CCN(c2cc(NCC3CCCCC3)c(N)cc2Nc2ccccc2)CC1, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["C1CCOC1"], "agent": ["[H][H]", "[Pd]"]} |
Using Oc1ccc2ccccc2c1, COC(=O)[C@@H]1C[C@@H](O)CN1C(=O)OC(C)(C)C to produce COC(=O)[C@@H]1C[C@H](Oc2ccc3ccccc3c2)CN1C(=O)OC(C)(C)C, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["C1CCOC1"], "agent": ["c1ccc(P(c2ccccc2)c2ccccc2)cc1", "CC(C)OC(=O)/N=N/C(=O)OC(C)C"]} |
Using CCOC(=O)c1cccc(S)c1, CCCn1cc(-n2ccc3ccc(Cl)cc32)cn1 to produce CCCn1cc(-n2cc(Sc3cccc(C(=O)OCC)c3)c3ccc(Cl)cc32)cn1, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["O", "ClCCl"], "agent": ["O=C1CCC(=O)N1Cl"]} |
Using C#CCc1c(C)nc2c(NCc3c(C)cccc3NC(=O)COC(C)=O)cccn12 to produce C#CCc1c(C)nc2c(NCc3c(C)cccc3NC(=O)CO)cccn12, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["O", "CO"], "agent": ["O=C([O-])[O-]", "[Na+]"]} |
Using COCCCCNc1ccccc1N, CC(C)CN(C(=O)C(=O)O)[C@H]1C[C@@H](C(=O)N2CCOCC2)CN(C(=O)OC(C)(C)C)C1 to produce COCCCCNc1ccccc1NC(=O)C(=O)N(CC(C)C)[C@H]1C[C@@H](C(=O)N2CCOCC2)CN(C(=O)OC(C)(C)C)C1, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["CN(C)C=O", "CCN(C(C)C)C(C)C"], "agent": ["CCN=C=NCCCN(C)C", "On1nnc2ccccc21", "Cl"]} |
Using CCOC(=O)C(=Cc1ccc(OC)cc1OC)C(=O)OCC, CCCCC[Mg]Br to produce CCCCCC(c1ccc(OC)cc1OC)C(C(=O)OCC)C(=O)OCC, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["CCOCC"], "agent": ["Cl"]} |
Using Cc1nc2c(NC(=O)C(C)(C)C)cccn2c1C, CCCC[Sn](Cl)(CCCC)CCCC to produce CCCC[Sn](CCCC)(CCCC)c1ccn2c(C)c(C)nc2c1NC(=O)C(C)(C)C, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["CCOCC", "CCCCC"], "agent": ["[Li]C(C)(C)C"]} |
Using O=C1Nc2ccc([N+](=O)[O-])cc2Nc2cscc21 to produce O=[N+]([O-])c1ccc2c(c1)Nc1cscc1CN2, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["C1CCOC1"], "agent": ["Cl", "B"]} |
Using [C-]#N, COc1cc(I)c2c(c1)CN(Cc1ccc(OC(F)(F)F)cc1)C2=O to produce COc1cc(C#N)c2c(c1)CN(Cc1ccc(OC(F)(F)F)cc1)C2=O, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["CC#N"], "agent": ["[Cu]I", "[Na+]", "c1ccc([P](c2ccccc2)(c2ccccc2)[Pd]([P](c2ccccc2)(c2ccccc2)c2ccccc2)([P](c2ccccc2)(c2ccccc2)c2ccccc2)[P](c2ccccc2)(c2ccccc2)c2ccccc2)cc1"]} |
Using CCCCCCCN(CCc1ccc(Cl)cc1)C(=O)Cc1ccc(OCc2ccccc2C(=O)OC)cc1 to produce CCCCCCCN(CCc1ccc(Cl)cc1)C(=O)Cc1ccc(OCc2ccccc2C(=O)O)cc1, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["CCO"], "agent": ["[K+]", "[OH-]"]} |
Using Cc1ccc([N+](=O)[O-])cc1N1CCc2nc(N)ncc2C1, Brc1cncnc1 to produce Cc1ccc([N+](=O)[O-])cc1N1CCc2nc(Nc3cncnc3)ncc2C1, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["C1COCCO1"], "agent": ["O=C([O-])[O-]", "CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21", "[Cs+]"]} |
Using C=CCCc1ccccc1B(O)O, C=CCN1CCOc2ccc(-c3c([C@H](OC(C)(C)C)C(=O)OC)c(C)nc4cc(-c5cccc(Br)c5)nn34)c(Cl)c21 to produce C=CCCc1ccccc1-c1cccc(-c2cc3nc(C)c([C@H](OC(C)(C)C)C(=O)OC)c(-c4ccc5c(c4Cl)N(CC=C)CCO5)n3n2)c1, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["CN(C)C=O"], "agent": ["O=C([O-])[O-]", "[Na+]", "c1ccc([P](c2ccccc2)(c2ccccc2)[Pd]([P](c2ccccc2)(c2ccccc2)c2ccccc2)([P](c2ccccc2)(c2ccccc2)c2ccccc2)[P](c2ccccc2)(c2ccccc2)c2ccccc2)cc1"]} |
Using CC(c1cc(-c2cnc(Oc3cccc(O)c3)s2)no1)N1C(=O)c2ccccc2C1=O, CC(C)O to produce CC(C)Oc1cccc(Oc2ncc(-c3cc(C(C)N4C(=O)c5ccccc5C4=O)on3)s2)c1, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["C1CCOC1"], "agent": ["c1ccc(P(c2ccccc2)c2ccccc2)cc1", "CCOC(=O)N=NC(=O)OCC"]} |
Using CC1(C)OC[C@@H](Cn2ccc(NC(=O)C(CC(F)(F)F)N3CC(Oc4ccccc4Cl)=CC3=O)n2)O1 to produce O=C(Nc1ccn(C[C@@H](O)CO)n1)C(CC(F)(F)F)N1CC(Oc2ccccc2Cl)=CC1=O, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["O", "CO"], "agent": ["Cc1ccc(S(=O)(=O)O)cc1"]} |
Using CC(C)(C)[Si](C)(C)O[C@@H](CNCCc1ccc(Oc2cccc(-c3ccccc3)c2)cc1)c1ccc(OCc2ccccc2)c2[nH]c(=O)ccc12 to produce O=c1ccc2c([C@@H](O)CNCCc3ccc(Oc4cccc(-c5ccccc5)c4)cc3)ccc(OCc3ccccc3)c2[nH]1, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["CCN(CC)CC", "C1CCOC1"], "agent": ["F", "[Na+]", "[OH-]"]} |
Using BrCCC1OCCO1, C=CC=O to produce C=CC(O)CCC1OCCO1, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["C1CCOC1"], "agent": ["[Mg]"]} |
Using NS(=O)(=O)c1ccccc1OC(F)(F)F, S=C=S to produce O=S(=O)(N=C=S)c1ccccc1OC(F)(F)F, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["CCOC(C)=O", "CN(C)C=O"], "agent": ["[K+]", "[OH-]"]} |
Using O=C(O)c1cnc2c(Cl)nn(Cc3c(Cl)cccc3Cl)c2c1 to produce O=C([O-])c1cnc2c(Cl)nn(Cc3c(Cl)cccc3Cl)c2c1, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["CCO"], "agent": ["[K+]", "[OH-]"]} |
Using CC(=O)OCC(=O)NCCc1cc(-c2ccc(S(C)(=O)=O)cc2)n(-c2ccccc2)c1C to produce Cc1c(CCNC(=O)CO)cc(-c2ccc(S(C)(=O)=O)cc2)n1-c1ccccc1, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["O", "CO"], "agent": ["O=C([O-])[O-]", "[K+]"]} |
Using Cc1nc2c(c(=O)n(CCCC[C@@H](C)O)c(=O)n2C)n1Cc1ccccc1 to produce Cc1nc2c([nH]1)c(=O)n(CCCC[C@@H](C)O)c(=O)n2C, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["CCOC(C)=O", "CC(=O)O"], "agent": ["[Pd]"]} |
Using O=c1onc2n1C(CO)CCCC2, BrC(Br)(Br)Br to produce O=c1onc2n1C(CBr)CCCC2, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["ClCCl"], "agent": ["c1ccc(P(c2ccccc2)c2ccccc2)cc1"]} |
Using Cc1cncc(Br)c1, SCc1ccccc1 to produce Cc1cncc(SCc2ccccc2)c1, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["Cc1ccccc1", "CCN(C(C)C)C(C)C"], "agent": ["O=C(/C=C/c1ccccc1)/C=C/c1ccccc1", "CC1(C)c2cccc(P(c3ccccc3)c3ccccc3)c2Oc2c(P(c3ccccc3)c3ccccc3)cccc21", "[Pd]"]} |
Using COC(=O)[C@@H](NC(=O)[C@@H](O)CC(C)C)c1ccccc1 to produce CC(C)C[C@H](O)C(=O)N[C@H](C(=O)O)c1ccccc1, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["O", "C1CCOC1"], "agent": ["[Li+]", "Cl", "[OH-]"]} |
Using O=C(O)c1ccc2[nH]ccc2c1, NCc1ccccc1 to produce O=C(NCc1ccccc1)c1ccc2[nH]ccc2c1, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["O", "C1CCOC1"], "agent": ["[Cl-]", "[Na+]"]} |
Using COc1cccc(/C(C#N)=C\c2ccc(C)c(C)c2)c1 to produce COc1cccc(C(C#N)Cc2ccc(C)c(C)c2)c1, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["CCO"], "agent": ["[Na+]", "[BH4-]"]} |
Using C=CC(=O)Nc1cccc([N+](=O)[O-])c1 to produce C=CC(=O)Nc1cccc(N)c1, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["O"], "agent": ["[Fe]"]} |
Using CC(C)(C)OC(=O)NCCCO, O=[N+]([O-])c1ccc(F)c(O)c1F to produce CC(C)(C)OC(=O)NCCCOc1c(F)ccc([N+](=O)[O-])c1F, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["C1CCOC1"], "agent": ["c1ccc(P(c2ccccc2)c2ccccc2)cc1", "CCOC(=O)N=NC(=O)OCC"]} |
Using COc1ccc2c(c1)C(COS(C)(=O)=O)CN(C(=O)OC(C)(C)C)C2, [C-]#N to produce COc1ccc2c(c1)C(CC#N)CN(C(=O)OC(C)(C)C)C2, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["O", "CS(C)=O"], "agent": ["[K+]"]} |
Using CC(=O)CCc1ccc2ncc(C(=O)[O-])n2c1 to produce CC(=O)CCc1ccc2ncc(C(=O)O)n2c1, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["C1CCOC1", "CO"], "agent": ["[Li+]", "O=C(O)CC(O)(CC(=O)O)C(=O)O", "[OH-]"]} |
Using [Cl-], CCCCCCCCCCCCCCCCCCCC(O)(CCCCCCCCCC)CCCCCCCCCCCCCC to produce CCCCCCCCCCCCCCCCCCCC(Cl)(CCCCCCCCCC)CCCCCCCCCCCCCC, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["ClCCl"], "agent": ["Cl", "[Ca+2]"]} |
Using CCN1C(=O)C(Cc2cccc(C#N)c2)N=C(c2ccccc2)c2cc(OC)c(OC)cc21 to produce CCN1C(=O)C(Cc2cccc(CN)c2)N=C(c2ccccc2)c2cc(OC)c(OC)cc21, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["CO"], "agent": ["[Ni]", "N"]} |
Using COC(=O)Cc1cc2ccc(F)cc2c(C2CCN(C(=O)c3cc(F)ccc3F)CC2)c1C to produce Cc1c(CC(=O)O)cc2ccc(F)cc2c1C1CCN(C(=O)c2cc(F)ccc2F)CC1, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["O", "C1CCOC1"], "agent": ["[Li+]", "[OH-]"]} |
Using COc1cccc(C(=O)C2CCN(C(=O)OC(C)(C)C)CC2)c1OC to produce COc1cccc(C(=O)C2CCNCC2)c1OC, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["C1CCOC1"], "agent": ["Cl"]} |
Using C=CCN1C[C@H](C)N([C@@H](c2cccc(O)c2)c2cccc(C(=O)N3CCC(=CC(=O)OCC)CC3)c2)C[C@H]1C to produce C=CCN1C[C@H](C)N([C@@H](c2cccc(O)c2)c2cccc(C(=O)N3CCC(=CC(=O)O)CC3)c2)C[C@H]1C, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["O", "CCO"], "agent": ["O=S(=O)(O)O", "[Na+]", "[OH-]"]} |
Using COC(=O)CCC/C=C\C[C@H]1CO[C@@H](C)O[C@H]1CO, ClCc1ccccn1 to produce COC(=O)CCC/C=C\C[C@H]1CO[C@@H](C)O[C@H]1COCc1ccccn1, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["CN(C)C=O"], "agent": ["[Na+]", "Cl", "[H-]"]} |
Using NN1CCOCC1, CCOC(=O)c1nn(-c2ccccc2Cl)c(-c2ccc(Cl)cc2)c1N to produce Nc1c(C(=O)NN2CCOCC2)nn(-c2ccccc2Cl)c1-c1ccc(Cl)cc1, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["ClC(Cl)Cl"], "agent": ["C[Al](C)C"]} |
Using COC(=O)c1ccc2c(n1)CCC1C2=NN(c2ccc(C#N)c(C)c2)C1C1CCCC1 to produce Cc1cc(N2N=C3c4ccc(C(=O)O)nc4CCC3C2C2CCCC2)ccc1C#N, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["C1CCOC1", "CO"], "agent": ["[Na+]", "[OH-]"]} |
Using COc1nc(OC)c(C(C)C)c(C(=O)c2cc(C)cc(C=O)c2)n1, CCOP(=O)(CC#N)OCC to produce COc1nc(OC)c(C(C)C)c(C(=O)c2cc(C)cc(C=CC#N)c2)n1, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["CCOCC", "C1CCOC1"], "agent": ["CC(C)(C)[O-]", "[K+]"]} |
Using O=S(=O)(Cl)c1ccc(CC(F)(F)F)cc1, CCCN(C(=O)OC(C)(C)C)[C@H]1CCc2cc(N)ccc2C1 to produce CCCN(C(=O)OC(C)(C)C)[C@H]1CCc2cc(NS(=O)(=O)c3ccc(CC(F)(F)F)cc3)ccc2C1, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["C1CCOC1"], "agent": ["CN(C)c1ccccn1"]} |
Using CC(=O)c1ccc(Cl)c([N+](=O)[O-])c1, Nc1ccc(CCO)cc1 to produce CC(=O)c1ccc(Nc2ccc(CCO)cc2)c([N+](=O)[O-])c1, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["O", "CN(C)C=O"], "agent": ["[Na+]", "O=C([O-])O"]} |
Using NC1(c2cncnc2)CC1, CNC(=O)c1c(-c2ccc(F)cc2)oc2ccc(-c3cc(C(=O)O)ccc3C)cc12 to produce CNC(=O)c1c(-c2ccc(F)cc2)oc2ccc(-c3cc(C(=O)NC4(c5cncnc5)CC4)ccc3C)cc12, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["ClCCl", "CCN(C(C)C)C(C)C"], "agent": ["CCN=C=NCCCN(C)C", "On1nnc2ccccc21", "Cl"]} |
Using Cc1ccc(C(=O)N[C@H](CN2CCN(Cc3ccc(Cl)c(Cl)c3)CC2)C(C)C)cc1, O=S(=O)(Cl)c1ccc(F)cc1 to produce CC(C)[C@H](CN1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)NS(=O)(=O)c1ccc(F)cc1, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["ClCCl", "CCN(CC)CC"], "agent": ["Cl"]} |
Using COc1ccc(CC(C)C)cc1OC to produce CC(C)Cc1ccc(O)c(O)c1, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["CC(=O)O", "O"], "agent": ["Br"]} |
Using BrC1CCCC1, COc1cc(F)c(C=O)cc1O to produce COc1cc(F)c(C=O)cc1OC1CCCC1, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["O", "CN(C)C=O"], "agent": ["O=C([O-])[O-]", "[K+]"]} |
Using CCOC(=O)N(CCCC1CCN(C)CC1)c1ncc(C#N)c(C)n1 to produce Cc1nc(NCCCC2CCN(C)CC2)ncc1C#N, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["CO"], "agent": ["[Na+]", "[OH-]"]} |
Using CCC(=O)c1ccc(OCCN(CC)CC)cc1, [Li]c1cccc(C(F)(F)F)c1 to produce CCN(CC)CCOc1ccc(C(O)(CC)c2cccc(C(F)(F)F)c2)cc1, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["CCOCC"], "agent": ["[Cl-]", "[NH4+]"]} |
Using Cc1cc2nc(Cl)nc(Cl)c2s1, [OH-] to produce Cc1cc2nc(Cl)[nH]c(=O)c2s1, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["C1CCOC1"], "agent": ["[Na+]", "Cl"]} |
Using CC(=O)OCC1=C(C(=O)OC(C)(C)C)N2C(=O)C(N)C2SC1, CON=C(C(=O)O)c1csc(NC(c2ccccc2)(c2ccccc2)c2ccccc2)n1 to produce CON=C(C(=O)NC1C(=O)N2C(C(=O)OC(C)(C)C)=C(COC(C)=O)CSC12)c1csc(NC(c2ccccc2)(c2ccccc2)c2ccccc2)n1, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["ClCCl", "CCN(CC)CC"], "agent": ["On1nnc2ccccc21"]} |
Using CCN(c1nc(C)cc(N2CCC(O)(c3cccs3)CC2)n1)c1ccc(C(C)C)cc1Br to produce CCN(c1nc(C)cc(N2CC=C(c3cccs3)CC2)n1)c1ccc(C(C)C)cc1Br, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["O=CO"], "agent": ["[Na+]", "O=C([O-])O"]} |
Using COC(=O)Cc1ccc(C#CCCO)cc1 to produce COC(=O)Cc1ccc(CCCCO)cc1, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["CCO"], "agent": ["[H][H]", "[Pd]"]} |
Using COc1c(C)cc2c(c1C)CCC1(CCC1)N2Cc1ccc2ccccc2n1 to produce Cc1cc2c(c(C)c1O)CCC1(CCC1)N2Cc1ccc2ccccc2n1, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["ClCCl"], "agent": ["BrB(Br)Br"]} |
Using CC(C)[C@H]1COC(=O)N1C(=O)[C@@H](CC(=O)N(C)C1CCCCC1)Cc1ccccc1, [OH-] to produce CN(C(=O)C[C@@H](Cc1ccccc1)C(=O)O)C1CCCCC1, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["O", "C1CCOC1"], "agent": ["[Li+]"]} |
Using CC(=O)c1c(C)cc(C)c(C)c1O, O=C([O-])[O-] to produce COc1c(C)c(C)cc(C)c1C(C)=O, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["CI", "CC(C)=O"], "agent": ["[K+]"]} |
Using COc1ccc(CN(c2nncs2)S(=O)(=O)c2cc(Cl)c(F)cc2F)c(OC)c1, Oc1ccc(C(F)(F)F)cc1-c1ccnnc1 to produce COc1ccc(CN(c2nncs2)S(=O)(=O)c2cc(Cl)c(Oc3ccc(C(F)(F)F)cc3-c3ccnnc3)cc2F)c(OC)c1, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["CS(C)=O"], "agent": ["O=C([O-])[O-]", "[K+]"]} |
Using COC(=O)C1CCCC2C(c3ccc(OC)cc3)=NOC2(N2CCCC2)C1 to produce COc1ccc(-c2noc3c2CCCC(C(=O)O)C3)cc1, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["O", "CC(=O)O"], "agent": ["O=S(=O)(O)O"]} |
Using Oc1cc(Cl)c(F)cc1I, COc1ccc(CN(c2ncns2)S(=O)(=O)c2ccc(F)c(C#N)c2)c(OC)c1 to produce COc1ccc(CN(c2ncns2)S(=O)(=O)c2ccc(Oc3cc(Cl)c(F)cc3I)c(C#N)c2)c(OC)c1, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["CS(C)=O"], "agent": ["O=C([O-])[O-]", "[K+]"]} |
Using CC(C)(C)c1ccc(C(=O)NCCc2ccc(F)cc2)c(Cl)c1 to produce CC(C)(C)c1ccc(CNCCc2ccc(F)cc2)c(Cl)c1, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["C1CCOC1"], "agent": ["[Na+]", "Cl", "[OH-]"]} |
Using CCOC(=O)C1=C(NC(=O)[C@H]2CCC(=O)C2)CCC2(CC2)C1, Fc1ccc(N2CCNCC2)cc1 to produce CCOC(=O)C1=C(NC(=O)[C@H]2CC[C@@H](N3CCN(c4ccc(F)cc4)CC3)C2)CCC2(CC2)C1, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["CC(=O)O", "ClCCCl"], "agent": ["[Na+]", "O=C([O-])O", "CC(=O)O[BH-](OC(C)=O)OC(C)=O"]} |
Using Cc1ccc(-c2nc(N)c(C#CCCCCC(=O)O)nc2-c2ccc(C)cc2)cc1 to produce Cc1ccc(-c2nc3cc(CCCCC(=O)O)[nH]c3nc2-c2ccc(C)cc2)cc1, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["O", "CC(C)(C)O"], "agent": ["CC(C)(C)[O-]", "[K+]"]} |
Using O=C1Nc2ccc(Br)cc2C(c2ccccc2)=NC1OC(=O)C(F)(F)F to produce O=C1Nc2ccc(Br)cc2C(c2ccccc2)=NC1O, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["CCO"], "agent": ["[Na+]", "O=C([O-])O"]} |
Using Cc1nn(C)c(=O)cc1-c1ccc(O)cc1, ClCCCBr to produce Cc1nn(C)c(=O)cc1-c1ccc(OCCCCl)cc1, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["CC(C)=O"], "agent": ["O=C([O-])[O-]", "[K+]"]} |
Using CC(=O)c1cn([C@H]2C[C@H](O)[C@@H](CN=[N+]=[N-])O2)c(=O)[nH]c1=O to produce CC(=O)c1cn([C@H]2C[C@H](O)[C@@H](CN)O2)c(=O)[nH]c1=O, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["CCO", "CO"], "agent": ["Cl", "[Pd]"]} |
Using BrCc1ccccc1, CCCCCOC1CCC(=O)N1 to produce CCCCCOC1CCC(=O)N1Cc1ccccc1, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["C1CCOC1"], "agent": ["[K+]", "[OH-]"]} |
Using CCOC(=N)N, COC(=O)CC(=O)CCl to produce CCOc1nc(O)cc(CCl)n1, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["CO"], "agent": ["[Na]", "Cl"]} |
Using C=CCBr, CC(=O)c1cccc(O)c1 to produce C=CCOc1cccc(C(C)=O)c1, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["CCOC(C)=O", "CC(C)=O"], "agent": ["O=C([O-])[O-]", "[K+]"]} |
Using Cc1cc(C(=O)N2CC(c3ccc(Cl)c(Cl)c3)C(C(CO[Si](C)(C)C(C)(C)C)Oc3ccc(Cl)cn3)C2)cnn1, CCCC[N+](CCCC)(CCCC)CCCC to produce Cc1ncc(C(=O)N2CC(c3ccc(Cl)c(Cl)c3)C(C(CO)Oc3ccc(Cl)cn3)C2)cn1, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["CCOC(C)=O", "C1CCOC1"], "agent": ["[F-]"]} |
Using CC(C)[Si](Cl)(C(C)C)C(C)C, OCc1cscn1 to produce CC(C)[Si](OCc1cscn1)(C(C)C)C(C)C, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["ClCCl"], "agent": ["c1c[nH]cn1"]} |
Using C[C@H](NC(=O)OC(C)(C)C)c1cccc(NCc2cccnc2)c1 to produce C[C@H](N)c1cccc(NCc2cccnc2)c1, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["C1COCCO1"], "agent": ["Cl"]} |
Using CCCCOC(=O)CCC#Cc1cccc(NCc2ccc(OC)cc2)n1 to produce CCCCOC(=O)CCCCc1cccc(NCc2ccc(OC)cc2)n1, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["CCO", "CCN(CC)CC"], "agent": ["[H][H]", "O=[Pt]=O"]} |
Using O=[N+]([O-])c1cccc(F)c1I to produce Nc1cccc(F)c1I, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["C1CCOC1"], "agent": ["[Na+]", "Cl", "[OH-]"]} |
Using O=[N+]([O-])c1ccc(F)c([N+](=O)[O-])c1, Cc1ccccc1NC(=O)c1ccc(O)cc1 to produce Cc1ccccc1NC(=O)c1ccc(Oc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc1, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["CC(C)=O"], "agent": ["O=C([O-])[O-]", "[K+]"]} |
Using O=C1CSC(=S)N1, COCCOc1ccc(C=O)cc1OC to produce COCCOc1ccc(C=C2SC(=S)NC2=O)cc1OC, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["CC(=O)O", "O"], "agent": ["[Na+]", "CC(=O)[O-]"]} |
Using CC(C)(C)[Si](OCCOC[C@H](Oc1ncnc2c1cnn2-c1ccccc1Cl)C(=O)Nc1ccccn1)(c1ccccc1)c1ccccc1 to produce O=C(Nc1ccccn1)[C@H](COCCO)Oc1ncnc2c1cnn2-c1ccccc1Cl, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["C1CCOC1"], "agent": ["[F-]", "CCCC[N+](CCCC)(CCCC)CCCC"]} |
Using O=C(O)c1cc(Cl)c(F)cc1F, NS(=O)(=O)C1CC1 to produce O=C(NS(=O)(=O)C1CC1)c1cc(Cl)c(F)cc1F, please predict the condition, including solvent and agent in SMILES notation in json format like:
```json
{
"solvent": [
"CCN(CC)CC",
"CCOC(C)=O"
],
"agent": ["[Na+]", "[H-]"]
}
```
| {"solvent": ["CCOC(C)=O"], "agent": ["O=C(n1ccnc1)n1ccnc1"]} |
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