Ethanol → 7-(2,3-dihydrobenzofuran-5-yl)-N-[4-[[N-methyl-N-(tetrahydropyran-4-yl)amino]methyl]phenyl]-1,1-dioxo-2,3-dihydro-1-benzothiepine-4-carboxamide
Reaction equation
[B:33]([O-:34])([O-:44])[O:45][c:35]1[cH:36][cH:37][c:38]2[c:39]([cH:43]1)[CH2:40][CH2:41][O:42]2.[Br:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([cH:32]1)[CH:7]=[C:8]([C:14](=[O:15])[NH:16][c:17]1[cH:18][cH:19][c:20]([CH2:23][N:24]([CH:25]3[CH2:26][CH2:27][O:28][CH2:29][CH2:30]3)[CH3:31])[cH:21][cH:22]1)[CH2:9][CH2:10][S:11]2(=[O:12])=[O:13].[C:46](=[O:47])([O-:48])[O-:49].[CH2:53]([OH:54])[CH3:55].[K+:50].[K+:51].[OH2:52].[c:56]1([CH3:57])[cH:58][cH:59][cH:60][cH:61][cH:62]1>>[c:2]1(-[c:35]2[cH:36][cH:37][c:38]3[c:39]([cH:43]2)[CH2:40][CH2:41][O:42]3)[cH:3][cH:4][c:5]2[c:6]([cH:32]1)[CH:7]=[C:8]([C:14](=[O:15])[NH:16][c:17]1[cH:18][cH:19][c:20]([CH2:23][N:24]([CH:25]3[CH2:26][CH2:27][O:28][CH2:29][CH2:30]3)[CH3:31])[cH:21][cH:22]1)[CH2:9][CH2:10][S:11]2(=[O:12])=[O:13]Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-ac42c33aef2c42ca8f9573be52db2d03
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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