Ethanol → 7-[4-[N-ethyl-N-(2-propoxyethyl)amino]phenyl]-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-:50])[O:51][c:35]1[cH:36][cH:37][c:38]([N:41]([CH2:42][CH2:43][O:44][CH2:45][CH2:46][CH3:47])[CH2:48][CH3:49])[cH:39][cH:40]1.[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:52](=[O:53])([O-:54])[O-:55].[CH2:59]([OH:60])[CH3:61].[K+:56].[K+:57].[OH2:58].[c:62]1([CH3:63])[cH:64][cH:65][cH:66][cH:67][cH:68]1>>[c:2]1(-[c:35]2[cH:36][cH:37][c:38]([N:41]([CH2:42][CH2:43][O:44][CH2:45][CH2:46][CH3:47])[CH2:48][CH3:49])[cH:39][cH:40]2)[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-7c22ae0ff33f4c41a070ce64248f0659
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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