Ethanol → 3-[3-[1-(2-Thenoylmethyl)-2-oxo-5-pivaloyl-8-methyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-3-yl]ureido]benzoic acid
Reaction equation
[CH3:43][CH2:44][OH:45].[O:46]1[CH2:47][CH2:48][CH2:49][CH2:50]1.[c:1]1([C:6](=[O:7])[CH2:8][N:9]2[C:10](=[O:42])[CH:11]([NH:27][C:28](=[O:29])[NH:30][c:31]3[cH:32][c:33]([C:37](=[O:38])[O:39][CH2:40][CH3:41])[cH:34][cH:35][cH:36]3)[CH2:12][N:13]([C:21]([C:22]([CH3:23])([CH3:24])[CH3:25])=[O:26])[c:14]3[c:15]2[cH:16][c:17]([CH3:20])[cH:18][cH:19]3)[cH:2][cH:3][cH:4][s:5]1>>[c:1]1([C:6](=[O:7])[CH2:8][N:9]2[C:10](=[O:42])[CH:11]([NH:27][C:28](=[O:29])[NH:30][c:31]3[cH:32][c:33]([C:37](=[O:38])[OH:39])[cH:34][cH:35][cH:36]3)[CH2:12][N:13]([C:21]([C:22]([CH3:23])([CH3:24])[CH3:25])=[O:26])[c:14]3[c:15]2[cH:16][c:17]([CH3:20])[cH:18][cH:19]3)[cH:2][cH:3][cH:4][s:5]1Participants
4
Reactant 3
Product 1
Sources & evidence
- ORD record
- ord-5beb8c700cb44009a984da5bee9cefb8
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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