Chloride → N-[9-chloro-7-(2,6-difluoro-phenyl)-5H-benzo[c]pyrimido[4,5-e]azepin-2-yl]-benzene-1,4-diamine
Reaction equation
[CH3:43][CH2:44][O:45][C:46](=[O:47])[CH3:48].[Cl-:37].[Cl:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([cH:34]1)[C:7]([c:26]1[c:27]([F:33])[cH:28][cH:29][cH:30][c:31]1[F:32])=[N:8][CH2:9][c:10]1[c:11]-2[n:12][c:13]([NH:16][c:17]2[cH:18][cH:19][c:20]([N+:23]([O-:24])=[O:25])[cH:21][cH:22]2)[n:14][cH:15]1.[Na+:42].[O-:38][C:39]([OH:40])=[O:41].[OH2:35].[OH2:36]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([cH:34]1)[C:7]([c:26]1[c:27]([F:33])[cH:28][cH:29][cH:30][c:31]1[F:32])=[N:8][CH2:9][c:10]1[c:11]-2[n:12][c:13]([NH:16][c:17]2[cH:18][cH:19][c:20]([NH2:23])[cH:21][cH:22]2)[n:14][cH:15]1Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-0f183a9a525846a4b6705f36a8de97ce
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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