Acetic Acid → Tert-butyl 5-[[3-fluoro-5-(trifluoromethyl)phenyl]methylamino]-7-methyl-8-(trifluoromethyl)-2,3,4,5-tetrahydro-1-benzazepine-1-carboxylate
Reaction equation
[C:1]([O:2][BH-:3]([O:4][C:5](=[O:6])[CH3:7])[O:8][C:9](=[O:10])[CH3:11])(=[O:12])[CH3:13].[C:56](=[O:57])([OH:58])[O-:59].[CH3:28][C:29](=[O:30])[OH:31].[Cl:61][CH:62]([Cl:63])[CH3:64].[F:15][c:16]1[cH:17][c:18]([CH:19]=[O:20])[cH:21][c:22]([C:24]([F:25])([F:26])[F:27])[cH:23]1.[NH2:32][CH:33]1[c:34]2[c:35]([cH:47][c:48]([C:52]([F:53])([F:54])[F:55])[c:49]([CH3:51])[cH:50]2)[N:36]([C:40](=[O:41])[O:42][C:43]([CH3:44])([CH3:45])[CH3:46])[CH2:37][CH2:38][CH2:39]1.[Na+:14].[Na+:60]>>[F:15][c:16]1[cH:17][c:18]([CH2:19][NH:32][CH:33]2[c:34]3[c:35]([cH:47][c:48]([C:52]([F:53])([F:54])[F:55])[c:49]([CH3:51])[cH:50]3)[N:36]([C:40](=[O:41])[O:42][C:43]([CH3:44])([CH3:45])[CH3:46])[CH2:37][CH2:38][CH2:39]2)[cH:21][c:22]([C:24]([F:25])([F:26])[F:27])[cH:23]1Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-d39cf21986da47efbe5223bcc1cd311c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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