Ethyl isocyanate → (E)-5-(3,4-dichlorostyryl)-N-ethyl-2,3-dihydro-1H-1,4-benzodiazepine-1-carboxamide
Reaction equation
[CH2:22]([CH3:23])[N:24]=[C:25]=[O:26].[Cl:1][c:2]1[cH:3][c:4]([CH:5]=[CH:6][C:7]2=[N:8][CH2:9][CH2:10][NH:11][c:12]3[c:13]2[cH:14][cH:15][cH:16][cH:17]3)[cH:18][cH:19][c:20]1[Cl:21]>>[Cl:1][c:2]1[cH:3][c:4]([CH:5]=[CH:6][C:7]2=[N:8][CH2:9][CH2:10][N:11]([C:25]([NH:24][CH2:22][CH3:23])=[O:26])[c:12]3[c:13]2[cH:14][cH:15][cH:16][cH:17]3)[cH:18][cH:19][c:20]1[Cl:21]Participants
3
Sources & evidence
- ORD record
- ord-cc1bb969e2b44f6eaf8abbc21a95d5b1
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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