Acetic Acid → N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-1-(cyclopentylmethyl)-N-(2-methyltetrazol-5-yl)-2,3,4,5,7,9-hexahydrofuro[3,4-h][1]benzazepin-5-amine
Reaction equation
[C:48]([O:49][BH-:50]([O:51][C:52](=[O:53])[CH3:54])[O:55][C:56](=[O:57])[CH3:58])(=[O:59])[CH3:60].[CH3:44][C:45](=[O:46])[OH:47].[CH:37]1([CH:42]=[O:43])[CH2:38][CH2:39][CH2:40][CH2:41]1.[Cl:62][CH2:63][Cl:64].[F:1][C:2]([c:3]1[cH:4][c:5]([CH2:6][N:7]([c:8]2[n:9][n:10][n:11]([CH3:13])[n:12]2)[CH:14]2[CH2:15][CH2:16][CH2:17][NH:18][c:19]3[c:20]2[cH:21][c:22]2[c:26]([cH:27]3)[CH2:25][O:24][CH2:23]2)[cH:28][c:29]([C:31]([F:32])([F:33])[F:34])[cH:30]1)([F:35])[F:36].[Na+:61]>>[F:1][C:2]([c:3]1[cH:4][c:5]([CH2:6][N:7]([c:8]2[n:9][n:10][n:11]([CH3:13])[n:12]2)[CH:14]2[CH2:15][CH2:16][CH2:17][N:18]([CH2:42][CH:37]3[CH2:38][CH2:39][CH2:40][CH2:41]3)[c:19]3[c:20]2[cH:21][c:22]2[c:26]([cH:27]3)[CH2:25][O:24][CH2:23]2)[cH:28][c:29]([C:31]([F:32])([F:33])[F:34])[cH:30]1)([F:35])[F:36]Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-144001a8189b49e6b41a9dfd6dbf15bb
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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