Water → 7-bromo-2,3-dihydro-alpha-propyl-5-(2-pyridyl)-2-thioxo-1H-1,4-benzodiazepin-1-acetic acid methyl ester
Reaction equation
[CH2:49]([Cl:50])[Cl:51].[CH3:1][O:2][C:3]([CH:4]([N:5]1[C:6](=[O:23])[CH2:7][N:8]=[C:9]([c:17]2[n:18][cH:19][cH:20][cH:21][cH:22]2)[c:10]2[c:11]1[cH:12][cH:13][c:14]([Br:16])[cH:15]2)[CH2:24][CH2:25][CH3:26])=[O:27].[OH2:48].[P:28]12(=[S:29])[S:30][P:31]3(=[S:41])[S:32][P:33](=[S:39])([S:34][P:35](=[S:38])([S:36]3)[S:37]1)[S:40]2.[cH:42]1[cH:43][cH:44][n:45][cH:46][cH:47]1>>[CH3:1][O:2][C:3]([CH:4]([N:5]1[C:6](=[S:29])[CH2:7][N:8]=[C:9]([c:17]2[n:18][cH:19][cH:20][cH:21][cH:22]2)[c:10]2[c:11]1[cH:12][cH:13][c:14]([Br:16])[cH:15]2)[CH2:24][CH2:25][CH3:26])=[O:27]Participants
6
Reactant 5
Product 1
Sources & evidence
- ORD record
- ord-5fe6532aaa5240419ede577cac3a855d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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