Bromide ion → 3-[N-(1-carboethoxy-3-phenylpropyl)amino]-1-carbomethoxymethyl-5-methyl-1,3,4,5-tetrahydro-1,5-benzo diazepin-2-one
Reaction equation
[Br-:37].[Br:31][CH2:32][C:33](=[O:34])[O:35][CH3:36].[C:1](=[O:2])([O:3][CH2:4][CH3:5])[CH:6]([CH2:7][CH2:8][c:9]1[cH:10][cH:11][cH:12][cH:13][cH:14]1)[NH:15][CH:16]1[CH2:17][N:18]([CH3:28])[c:19]2[c:20]([cH:24][cH:25][cH:26][cH:27]2)[NH:21][C:22]1=[O:23].[CH3:38][CH2:39][CH2:40][CH2:41][N+:42]([CH2:43][CH2:44][CH2:45][CH3:46])([CH2:47][CH2:48][CH2:49][CH3:50])[CH2:51][CH2:52][CH2:53][CH3:54].[K+:30].[O:55]1[CH2:56][CH2:57][CH2:58][CH2:59]1.[OH-:29]>>[C:1](=[O:2])([O:3][CH2:4][CH3:5])[CH:6]([CH2:7][CH2:8][c:9]1[cH:10][cH:11][cH:12][cH:13][cH:14]1)[NH:15][CH:16]1[CH2:17][N:18]([CH3:28])[c:19]2[c:20]([cH:24][cH:25][cH:26][cH:27]2)[N:21]([CH2:32][C:33](=[O:34])[O:35][CH3:36])[C:22]1=[O:23]Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-9a07825fd6bc47358347a6f30f45f744
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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