Ethanol → N-[(3RS)-1-hydroxycarbonylmethyl-5-(2-fluorophenyl)-2,3-dihydro-2-oxo-1H-1,4-benzodiazepin-3-yl]-N'-(3-methylphenyl)urea
Reaction equation
[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[CH2:6][N:7]1[C:8](=[O:36])[CH:9]([NH:25][C:26](=[O:27])[NH:28][c:29]2[cH:30][c:31]([CH3:35])[cH:32][cH:33][cH:34]2)[N:10]=[C:11]([c:18]2[c:19]([F:24])[cH:20][cH:21][cH:22][cH:23]2)[c:12]2[c:13]1[cH:14][cH:15][cH:16][cH:17]2.[CH2:42]1[O:43][CH2:44][CH2:45][CH2:46]1.[CH3:39][CH2:40][OH:41].[CH3:47][OH:48].[CH:49]([O:50][CH:51]([CH3:52])[CH3:53])([CH3:54])[CH3:55].[Na+:38].[OH-:37]>>[O:3]=[C:4]([OH:5])[CH2:6][N:7]1[C:8](=[O:36])[CH:9]([NH:25][C:26](=[O:27])[NH:28][c:29]2[cH:30][c:31]([CH3:35])[cH:32][cH:33][cH:34]2)[N:10]=[C:11]([c:18]2[c:19]([F:24])[cH:20][cH:21][cH:22][cH:23]2)[c:12]2[c:13]1[cH:14][cH:15][cH:16][cH:17]2Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-e9bef468bf214fe582976bbaa8d8c329
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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