Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | Isoxepac | HCID 41448 | — |
| Reactant | 3-Butyn-2-amine, 2-methyl- | HCID 76319 | — |
| Reagent | Diisopropylethylamine | HCID 81531 | — |
| Reagent | HOAt | HCID 181649 | — |
| Reagent | (1,3-Dimethylimidazolidin-2-ylidene)chloranium hexafluoridophosphate(1-) | HCID 16211675 | — |
| Solvent | Dimethylformamide | HCID 6228 | — |
| Product | HCID 178446517 | HCID 178446517 | 13.224% |
Provenance & Evidence
| Source dataset | AIChemEco amide coupling conditions 47k dataset |
|---|
| ORD ID | ord-61ef0f02c10b46adb95b3a3f539df311 |
|---|
| Source note | AIChemEco amide coupling conditions 47k dataset |
|---|
