Dichloromethane → N-tert-butyl-3-[[4-[3-fluoro-4-(2-methylpropylcarbamoylamino)benzoyl]-2-propan-2-ylpiperazin-1-yl]methyl]benzamide
Reaction equation
[CH2:47]([CH:48]([CH3:49])[CH3:50])[NH2:51].[Cl:34][C:35](=[O:36])[O:37][c:38]1[cH:39][cH:40][c:41]([N+:42]([O-:43])=[O:44])[cH:45][cH:46]1.[Cl:52][CH2:53][Cl:54].[NH2:1][c:2]1[c:3]([F:33])[cH:4][c:5]([C:6](=[O:7])[N:8]2[CH2:9][CH:10]([CH:28]([CH3:29])[CH3:30])[N:11]([CH2:14][c:15]3[cH:16][c:17]([C:18](=[O:19])[NH:20][C:21]([CH3:22])([CH3:23])[CH3:24])[cH:25][cH:26][cH:27]3)[CH2:12][CH2:13]2)[cH:31][cH:32]1>>[NH:1]([c:2]1[c:3]([F:33])[cH:4][c:5]([C:6](=[O:7])[N:8]2[CH2:9][CH:10]([CH:28]([CH3:29])[CH3:30])[N:11]([CH2:14][c:15]3[cH:16][c:17]([C:18](=[O:19])[NH:20][C:21]([CH3:22])([CH3:23])[CH3:24])[cH:25][cH:26][cH:27]3)[CH2:12][CH2:13]2)[cH:31][cH:32]1)[C:35](=[O:36])[NH:51][CH2:47][CH:48]([CH3:49])[CH3:50]Participants
5
Reactant 4
Product 1
Sources & evidence
- ORD record
- ord-911f0821838b46bfbe33ce2e19f50c9a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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