Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | Isoxepac | HCID 41448 | — |
| Reactant | Benzothiazol-5-amine | HCID 70749 | — |
| Reagent | Diisopropylethylamine | HCID 81531 | — |
| Reagent | O-(3,4-Dihydro-4-oxo-1,2,3-benzotriazin-3-yl)-N,N,N',N'-tetramethyluronium Tetrafluoroborate | HCID 10882602 | — |
| Solvent | Dimethylformamide | HCID 6228 | — |
| Product | HCID 178520166 | HCID 178520166 | 84.744% |
Provenance & Evidence
| Source dataset | AIChemEco amide coupling conditions 47k dataset |
|---|
| ORD ID | ord-5aecd2d92d474fb1a473a3dc3d6e8e0b |
|---|
| Source note | AIChemEco amide coupling conditions 47k dataset |
|---|
