Methanol → 7-bromo-2,3-dihydro-2-oxo-alpha-propyl-5-(2-pyridyl)-1H-1,4-benzodiazepine-1-acetic acid methyl ester
Reaction equation
[Br:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([cH:19]1)[C:7]([c:13]1[n:14][cH:15][cH:16][cH:17][cH:18]1)=[N:8][CH2:9][C:10](=[O:12])[NH:11]2.[Br:28][CH:29]([C:30](=[O:31])[O:32][CH3:33])[CH2:34][CH2:35][CH3:36].[CH2:39]([Cl:40])[Cl:41].[CH2:42]([Cl:43])[Cl:44].[CH3:20][O-:21].[CH3:23][N:24]([CH3:25])[CH:26]=[O:27].[CH3:37][OH:38].[CH3:45][OH:46].[CH3:48][c:49]1[cH:50][cH:51][cH:52][cH:53][cH:54]1.[Na+:22].[OH2:47]>>[Br:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([cH:19]1)[C:7]([c:13]1[n:14][cH:15][cH:16][cH:17][cH:18]1)=[N:8][CH2:9][C:10](=[O:12])[N:11]2[CH:29]([C:30](=[O:31])[O:32][CH3:33])[CH2:34][CH2:35][CH3:36]Participants
10
Reactant 9
Product 1
Sources & evidence
- ORD record
- ord-9969e0d9fe23465d9dc983db5c13c1cf
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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