Water → 7-[4-(2-butoxyethoxy)phenyl]-1-isobutyl-N-[1-methyl-2-(((1-propylimidazol-5-yl)methyl)sulfanyl)benzimidazol-6-yl]-2,3-dihydro-1H-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:32]2)[CH:20]=[C:21]([C:29](=[O:30])[OH:31])[CH2:22][CH2:23][N:24]3[CH2:25][CH:26]([CH3:27])[CH3:28])[cH:13][cH:14]1.[NH2:42][c:43]1[cH:44][cH:45][c:46]2[c:47]([n:48]([CH3:61])[c:49]([S:51][CH2:52][c:53]3[cH:54][n:55][cH:56][n:57]3[CH2:58][CH2:59][CH3:60])[n:50]2)[cH:62]1.[O:33]=[CH:34][N:35]([CH3:36])[CH3:37].[O:63]1[CH2:64][CH2:65][CH2:66][CH2:67]1.[OH2:74].[S:38]([Cl:39])([Cl:40])=[O:41].[cH:68]1[cH:69][cH:70][n:71][cH:72][cH:73]1>>[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:32]2)[CH:20]=[C:21]([C:29](=[O:30])[NH:42][c:43]2[cH:44][cH:45][c:46]4[c:47]([n:48]([CH3:61])[c:49]([S:51][CH2:52][c:53]5[cH:54][n:55][cH:56][n:57]5[CH2:58][CH2:59][CH3:60])[n:50]4)[cH:62]2)[CH2:22][CH2:23][N:24]3[CH2:25][CH:26]([CH3:27])[CH3:28])[cH:13][cH:14]1Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-14daa08adab64e4ab3c742066bc840ec
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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