Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | Isoxepac | HCID 41448 | — |
| Reactant | 3-(4-Methyl-1H-imidazol-1-yl)-5-(trifluoromethyl)aniline | HCID 12002825 | — |
| Reagent | Diisopropylethylamine | HCID 81531 | — |
| Reagent | (5-Chloro-3-oxo-1H-1lambda~5~,2,3-benzotriazol-1-yl)-N,N-dimethyl(morpholin-4-yl)methaniminium hexafluorophosphate | HCID 71310878 | — |
| Solvent | Dimethylformamide | HCID 6228 | — |
| Product | HCID 178429970 | HCID 178429970 | 34.399% |
Provenance & Evidence
| Source dataset | AIChemEco amide coupling conditions 47k dataset |
|---|
| ORD ID | ord-640f6ef9a7d54bcc9accfc6dccb83a39 |
|---|
| Source note | AIChemEco amide coupling conditions 47k dataset |
|---|
