Acetic Acid → N-(2-hydroxyethyl)-2-(2-(4-((2,2,2-trifluoroethylamino)methyl)-3-(trifluoromethyl)-1H-pyrazol-1-yl)acetamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxamide
Reaction equation
[C:40]([O:41][BH-:42]([O:43][C:44](=[O:45])[CH3:46])[O:47][C:48](=[O:49])[CH3:50])(=[O:51])[CH3:52].[CH3:54][C:55](=[O:56])[OH:57].[CH:1](=[O:2])[c:3]1[c:4]([C:27]([F:28])([F:29])[F:30])[n:5][n:6]([CH2:8][C:9](=[O:10])[NH:11][c:12]2[c:13]([C:21](=[O:22])[NH:23][CH2:24][CH2:25][OH:26])[c:14]3[c:15]([s:16]2)[CH2:17][CH2:18][CH2:19][CH2:20]3)[cH:7]1.[Cl:37][CH2:38][Cl:39].[F:31][C:32]([CH2:33][NH2:34])([F:35])[F:36].[Na+:53]>>[CH2:1]([c:3]1[c:4]([C:27]([F:28])([F:29])[F:30])[n:5][n:6]([CH2:8][C:9](=[O:10])[NH:11][c:12]2[c:13]([C:21](=[O:22])[NH:23][CH2:24][CH2:25][OH:26])[c:14]3[c:15]([s:16]2)[CH2:17][CH2:18][CH2:19][CH2:20]3)[cH:7]1)[NH:34][CH2:33][C:32]([F:31])([F:35])[F:36]Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-30588ae30e1042698e7e793fbf1d1890
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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