Benzoic Acid → N-Propyl-N-(3,3,3-trifluoro-2-hydroxy-2-{[(6-methyl-1-phenyl-1H-indazol-4-yl)amino]methyl}propyl)benzamide
Reaction equation
[F:10][C:11]([C:12]([CH2:13][NH:14][c:15]1[c:16]2[cH:17][n:18][n:19](-[c:25]3[cH:26][cH:27][cH:28][cH:29][cH:30]3)[c:20]2[cH:21][c:22]([CH3:24])[cH:23]1)([OH:31])[CH2:32][NH:33][CH2:34][CH2:35][CH3:36])([F:37])[F:38].[OH:1][C:2](=[O:3])[c:4]1[cH:5][cH:6][cH:7][cH:8][cH:9]1>>[C:2](=[O:3])([c:4]1[cH:5][cH:6][cH:7][cH:8][cH:9]1)[N:33]([CH2:32][C:12]([C:11]([F:10])([F:37])[F:38])([CH2:13][NH:14][c:15]1[c:16]2[cH:17][n:18][n:19](-[c:25]3[cH:26][cH:27][cH:28][cH:29][cH:30]3)[c:20]2[cH:21][c:22]([CH3:24])[cH:23]1)[OH:31])[CH2:34][CH2:35][CH3:36]Participants
3
Sources & evidence
- ORD record
- ord-0020b81b887e403a8774418266efc9b4
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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