Chloride → 8-Chloro-4-[3-(2-cyclopropylaminomethyl-pyridin-4-yl)-phenyl]-7-methyl-1,3-dihydro-benzo[b][1,4]diazepin-2-one
Reaction equation
[CH:34]1([NH2:37])[CH2:35][CH2:36]1.[Cl-:33].[Cl:1][c:2]1[c:3]([CH3:28])[cH:4][c:5]2[c:6]([cH:27]1)[NH:7][C:8](=[O:26])[CH2:9][C:10]([c:12]1[cH:13][c:14](-[c:18]3[cH:19][c:20]([CH2:24][OH:25])[n:21][cH:22][cH:23]3)[cH:15][cH:16][cH:17]1)=[N:11]2.[Cl:38][CH2:39][Cl:40].[O:41]=[CH:42][N:43]([CH3:44])[CH3:45].[S:29]([Cl:30])([Cl:31])=[O:32]>>[Cl:1][c:2]1[c:3]([CH3:28])[cH:4][c:5]2[c:6]([cH:27]1)[NH:7][C:8](=[O:26])[CH2:9][C:10]([c:12]1[cH:13][c:14](-[c:18]3[cH:19][c:20]([CH2:24][NH:37][CH:34]4[CH2:35][CH2:36]4)[n:21][cH:22][cH:23]3)[cH:15][cH:16][cH:17]1)=[N:11]2Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-995b5e55cd654eb78565fdb6ba6df525
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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