Acetic Acid → N-{3-[(2-chloro-4-methylaminopyrimidin-5-ylmethyl)amino]-4-methylphenyl}-3-trifluoromethylbenzamide
Reaction equation
[C:33]([BH3-:34])#[N:35].[CH3:37][C:38](=[O:39])[OH:40].[CH3:41][OH:42].[Cl:1][c:2]1[n:3][cH:4][c:5]([CH:10]=[O:11])[c:6]([NH:8][CH3:9])[n:7]1.[Cl:43][CH:44]([Cl:45])[Cl:46].[NH2:12][c:13]1[cH:14][c:15]([NH:20][C:21]([c:22]2[cH:23][c:24]([C:28]([F:29])([F:30])[F:31])[cH:25][cH:26][cH:27]2)=[O:32])[cH:16][cH:17][c:18]1[CH3:19].[Na+:36]>>[Cl:1][c:2]1[n:3][cH:4][c:5]([CH2:10][NH:12][c:13]2[cH:14][c:15]([NH:20][C:21]([c:22]3[cH:23][c:24]([C:28]([F:29])([F:30])[F:31])[cH:25][cH:26][cH:27]3)=[O:32])[cH:16][cH:17][c:18]2[CH3:19])[c:6]([NH:8][CH3:9])[n:7]1Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-6506ecddaaeb4491a4ceb14f8c45693a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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