Methanol → 3-[3-[1-(2-toluoylmethyl)-2-oxo-5-benzyloxycarbonyl-8-methyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-3-yl]ureido]benzoic acid
Reaction equation
[CH3:57][OH:58].[Li+:51].[O:52]1[CH2:53][CH2:54][CH2:55][CH2:56]1.[OH-:50].[OH2:49].[c:1]1([CH3:48])[c:2]([C:7](=[O:8])[CH2:9][N:10]2[C:11](=[O:47])[CH:12]([NH:32][C:33](=[O:34])[NH:35][c:36]3[cH:37][c:38]([C:42](=[O:43])[O:44][CH2:45][CH3:46])[cH:39][cH:40][cH:41]3)[CH2:13][N:14]([C:22](=[O:23])[O:24][CH2:25][c:26]3[cH:27][cH:28][cH:29][cH:30][cH:31]3)[c:15]3[c:16]2[cH:17][c:18]([CH3:21])[cH:19][cH:20]3)[cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([CH3:48])[c:2]([C:7](=[O:8])[CH2:9][N:10]2[C:11](=[O:47])[CH:12]([NH:32][C:33](=[O:34])[NH:35][c:36]3[cH:37][c:38]([C:42](=[O:43])[OH:44])[cH:39][cH:40][cH:41]3)[CH2:13][N:14]([C:22](=[O:23])[O:24][CH2:25][c:26]3[cH:27][cH:28][cH:29][cH:30][cH:31]3)[c:15]3[c:16]2[cH:17][c:18]([CH3:21])[cH:19][cH:20]3)[cH:3][cH:4][cH:5][cH:6]1Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-dc9131cdcbe54824b691f30f881d84db
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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