Sodium ion → cis-4-{[4-chloro-6-(methylamino)-2-pyrimidinyl]amino}-N-{[2-(trifluoromethyl)phenyl]methyl}cyclohexanecarboxamide
Reaction equation
[CH3:41][C:42]#[N:43].[Cl:1][c:2]1[n:3][c:4]([Cl:10])[cH:5][c:6]([NH:8][CH3:9])[n:7]1.[NH2:11][CH:12]1[CH2:13][CH2:14][CH:15]([C:18](=[O:19])[NH:20][CH2:21][c:22]2[c:23]([C:28]([F:29])([F:30])[F:31])[cH:24][cH:25][cH:26][cH:27]2)[CH2:16][CH2:17]1.[Na+:40].[O-:32][C:33]([C:34]([F:35])([F:36])[F:37])=[O:38].[OH-:39].[OH2:44]>>[c:2]1([NH:11][CH:12]2[CH2:13][CH2:14][CH:15]([C:18](=[O:19])[NH:20][CH2:21][c:22]3[c:23]([C:28]([F:29])([F:30])[F:31])[cH:24][cH:25][cH:26][cH:27]3)[CH2:16][CH2:17]2)[n:3][c:4]([Cl:10])[cH:5][c:6]([NH:8][CH3:9])[n:7]1Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-26058d91528c4163aa8031229c8e7e5a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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