Dimethylformamide → 4-[4,4-bis(4-fluorophenyl)butyl]-N-(2-chloro-6-methylphenyl)-3-(hydroxymethyl)-1-piperazineacetamide
Reaction equation
[CH3:40][CH2:41][N:42]([CH2:43][CH3:44])[CH2:45][CH3:46].[CH3:47][N:48]([CH3:49])[CH:50]=[O:51].[Cl:20][c:21]1[c:22]([NH:28][C:29]([CH2:30][N:31]2[CH2:32][CH:33]([CH2:37][OH:38])[NH:34][CH2:35][CH2:36]2)=[O:39])[c:23]([CH3:27])[cH:24][cH:25][cH:26]1.[I:1][CH2:2][CH2:3][CH2:4][CH:5]([c:6]1[cH:7][cH:8][c:9]([F:12])[cH:10][cH:11]1)[c:13]1[cH:14][cH:15][c:16]([F:19])[cH:17][cH:18]1>>[CH2:2]([CH2:3][CH2:4][CH:5]([c:6]1[cH:7][cH:8][c:9]([F:12])[cH:10][cH:11]1)[c:13]1[cH:14][cH:15][c:16]([F:19])[cH:17][cH:18]1)[N:34]1[CH:33]([CH2:37][OH:38])[CH2:32][N:31]([CH2:30][C:29]([NH:28][c:22]2[c:21]([Cl:20])[cH:26][cH:25][cH:24][c:23]2[CH3:27])=[O:39])[CH2:36][CH2:35]1Participants
5
Reactant 4
Product 1
Sources & evidence
- ORD record
- ord-76fcd993b8e44887b343a4d1dfa26278
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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