Sodium ion → 7-[4-(2-butoxyethoxy)phenyl]-N-[4-[(1-ethylimidazol-2-yl)methylsulfinyl]phenyl]-1-isobutyl-2,3-dihydro-1-benzazepine-4-carboxamide
Reaction equation
[CH2:1]([CH2:2][CH2:3][CH3:4])[O:5][CH2:6][CH2:7][O:8][c:9]1[cH:10][cH:11][c:12](-[c:15]2[cH:16][cH:17][c:18]3[c:19]([cH:47]2)[CH:20]=[C:21]([C:29](=[O:30])[NH:31][c:32]2[cH:33][cH:34][c:35]([S:38][CH2:39][c:40]4[n:41]([CH2:45][CH3:46])[cH:42][cH:43][n:44]4)[cH:36][cH:37]2)[CH2:22][CH2:23][N:24]3[CH2:25][CH:26]([CH3:27])[CH3:28])[cH:13][cH:14]1.[Cl:66][CH2:67][Cl:68].[Na+:64].[Na+:65].[OH:48][O:49][C:50]([c:51]1[cH:52][c:53]([Cl:54])[cH:55][cH:56][cH:57]1)=[O:58].[S:59]([O-:60])([O-:61])(=[O:62])=[S:63]>>[CH2:1]([CH2:2][CH2:3][CH3:4])[O:5][CH2:6][CH2:7][O:8][c:9]1[cH:10][cH:11][c:12](-[c:15]2[cH:16][cH:17][c:18]3[c:19]([cH:47]2)[CH:20]=[C:21]([C:29](=[O:30])[NH:31][c:32]2[cH:33][cH:34][c:35]([S:38]([CH2:39][c:40]4[n:41]([CH2:45][CH3:46])[cH:42][cH:43][n:44]4)=[O:48])[cH:36][cH:37]2)[CH2:22][CH2:23][N:24]3[CH2:25][CH:26]([CH3:27])[CH3:28])[cH:13][cH:14]1Participants
6
Reactant 5
Product 1
Sources & evidence
- ORD record
- ord-53675eb845d64bea81b4eaa0ecabde06
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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