Acetic Acid → 8-Chloro-3-hydroxy-2-(4-methoxyphenyl)-5-[2-(methylamino)ethyl]-2,3-dihydro-1,5-benzothiazepin-4-one
Reaction equation
[BrH:5].[C:1]([OH:2])(=[O:3])[CH3:4].[CH3:6][O:7][c:8]1[cH:9][cH:10][c:11]([CH:14]2[S:15][c:16]3[c:17]([cH:37][cH:38][c:39]([Cl:41])[cH:40]3)[N:18]([CH2:23][CH2:24][N:25]([CH3:26])[C:27]([O:28][CH2:29][c:30]3[cH:31][cH:32][cH:33][cH:34][cH:35]3)=[O:36])[C:19](=[O:22])[CH:20]2[OH:21])[cH:12][cH:13]1.[cH:42]1[cH:43][cH:44][cH:45][cH:46][cH:47]1>>[CH3:6][O:7][c:8]1[cH:9][cH:10][c:11]([CH:14]2[S:15][c:16]3[c:17]([cH:37][cH:38][c:39]([Cl:41])[cH:40]3)[N:18]([CH2:23][CH2:24][NH:25][CH3:26])[C:19](=[O:22])[CH:20]2[OH:21])[cH:12][cH:13]1Participants
5
Reactant 4
Product 1
Sources & evidence
- ORD record
- ord-ba273411581747a19362aaa5173c4dd8
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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