1,2-Dichloroethane → 1-[6-chloro-5-(2-fluorophenyl)-1,3-dimethyl-2-oxo-3H-1,4-benzodiazepin-7-yl]-3-(2-hydroxyethyl)urea
Reaction equation
[CH3:28][CH2:29][N:30]([CH2:31][CH3:32])[CH2:33][CH3:34].[Cl:1][C:2]([Cl:3])=[O:4].[Cl:39][CH2:40][CH2:41][Cl:42].[NH2:35][CH2:36][CH2:37][OH:38].[NH2:5][c:6]1[cH:7][cH:8][c:9]2[c:10]([c:26]1[Cl:27])[C:11]([c:19]1[c:20]([F:25])[cH:21][cH:22][cH:23][cH:24]1)=[N:12][CH:13]([CH3:18])[C:14](=[O:17])[N:15]2[CH3:16]>>[C:2](=[O:4])([NH:5][c:6]1[cH:7][cH:8][c:9]2[c:10]([c:26]1[Cl:27])[C:11]([c:19]1[c:20]([F:25])[cH:21][cH:22][cH:23][cH:24]1)=[N:12][CH:13]([CH3:18])[C:14](=[O:17])[N:15]2[CH3:16])[NH:35][CH2:36][CH2:37][OH:38]Participants
6
Sources & evidence
- ORD record
- ord-a9eb40c2b4d04d1397d30be6ef0f32ab
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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