1,2-Dichloroethane → ethyl 3-(2-fluoro-4-{[4-({5-(2-phenylethyl)-3-[4-(trifluoromethyl)phenyl]-1H-pyrazol-1-yl}methyl)benzyl]amino}phenyl)propanoate
Reaction equation
[C:52]([O:53][BH-:54]([O:55][C:56](=[O:57])[CH3:58])[O:59][C:60](=[O:61])[CH3:62])(=[O:63])[CH3:64].[CH3:48][C:49](=[O:50])[OH:51].[Cl:71][CH2:72][CH2:73][Cl:74].[NH2:33][c:34]1[cH:35][c:36]([F:47])[c:37]([CH2:40][CH2:41][C:42](=[O:43])[O:44][CH2:45][CH3:46])[cH:38][cH:39]1.[Na+:65].[Na+:66].[OH:67][C:68](=[O:69])[O-:70].[c:1]1([CH2:7][CH2:8][c:9]2[cH:10][c:11](-[c:23]3[cH:24][cH:25][c:26]([C:29]([F:30])([F:31])[F:32])[cH:27][cH:28]3)[n:12][n:13]2[CH2:14][c:15]2[cH:16][cH:17][c:18]([CH:19]=[O:20])[cH:21][cH:22]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([CH2:7][CH2:8][c:9]2[cH:10][c:11](-[c:23]3[cH:24][cH:25][c:26]([C:29]([F:30])([F:31])[F:32])[cH:27][cH:28]3)[n:12][n:13]2[CH2:14][c:15]2[cH:16][cH:17][c:18]([CH2:19][NH:33][c:34]3[cH:35][c:36]([F:47])[c:37]([CH2:40][CH2:41][C:42](=[O:43])[O:44][CH2:45][CH3:46])[cH:38][cH:39]3)[cH:21][cH:22]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-60c97250062a4652a489f0c52314c96b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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