Water → 6-Fluoro-1H-indole-7-carboxylic acid (4-tert-butyl-benzyl)-[2-(3,5-difluoro-phenyl)-ethyl]-amide
Reaction equation
[B-:14]([F:15])([F:16])([F:17])[F:18].[C:45]([CH3:46])([CH3:47])([CH3:48])[c:49]1[cH:50][cH:51][c:52]([CH2:53][NH:54][CH2:55][CH2:56][c:57]2[cH:58][c:59]([F:64])[cH:60][c:61]([F:63])[cH:62]2)[cH:65][cH:66]1.[CH:36]([N:37]([CH2:38][CH3:39])[CH:40]([CH3:41])[CH3:42])([CH3:43])[CH3:44].[F:1][c:2]1[cH:3][cH:4][c:5]2[cH:6][cH:7][nH:8][c:9]2[c:10]1[C:11](=[O:12])[OH:13].[O:67]=[CH:68][N:69]([CH3:70])[CH3:71].[OH2:72].[n:19]1([O:20][C:21]([N:22]([CH3:23])[CH3:24])=[N+:25]([CH3:26])[CH3:27])[c:28]2[cH:29][cH:30][cH:31][cH:32][c:33]2[n:34][n:35]1>>[F:1][c:2]1[cH:3][cH:4][c:5]2[cH:6][cH:7][nH:8][c:9]2[c:10]1[C:11](=[O:13])[N:54]([CH2:53][c:52]1[cH:51][cH:50][c:49]([C:45]([CH3:46])([CH3:47])[CH3:48])[cH:66][cH:65]1)[CH2:55][CH2:56][c:57]1[cH:58][c:59]([F:64])[cH:60][c:61]([F:63])[cH:62]1Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-fb1c5df899604832a1701db15349b8bc
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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