3-(2-Methyl-1H-imidazole-1-yl)-5-(trifluoromethyl)aniline → 4-methyl-N-[3-(2-methylimidazol-1-yl)-5-trifluoromethyl-phenyl]-3[4-(4-methylimidazol-1-yl)-pyrimidin-2-ylamino]-benzamide

HRID 85985Notes

Reaction equation

HRID 85985 reaction equation
[CH3:1][c:2]1[c:3]([NH:11][c:12]2[n:13][cH:14][cH:15][c:16](-[n:18]3[cH:19][n:20][c:21]([CH3:23])[cH:22]3)[n:17]2)[cH:4][c:5]([C:6](=[O:7])[OH:8])[cH:9][cH:10]1.[CH3:24][c:25]1[n:26](-[c:30]2[cH:31][c:32]([NH2:40])[cH:33][c:34]([C:36]([F:37])([F:38])[F:39])[cH:35]2)[cH:27][cH:28][n:29]1>>[CH3:1][c:2]1[c:3]([NH:11][c:12]2[n:13][cH:14][cH:15][c:16](-[n:18]3[cH:19][n:20][c:21]([CH3:23])[cH:22]3)[n:17]2)[cH:4][c:5]([C:6](=[O:8])[NH:40][c:32]2[cH:31][c:30](-[n:26]3[c:25]([CH3:24])[n:29][cH:28][cH:27]3)[cH:35][c:34]([C:36]([F:37])([F:38])[F:39])[cH:33]2)[cH:9][cH:10]1

Participants

3

Reactant 2

HCID 667757113-(2-Methyl-1H-imidazole-1-yl)-5-(trifluoromethyl)anilineHCID 688511964-Methyl-3-[4-(4-methylimidazol-1-yl)pyrimidin-2-yl-amino]benzoic acid

Product 1

HCID 688524274-methyl-N-[3-(2-methylimidazol-1-yl)-5-trifluoromethyl-phenyl]-3[4-(4-methylimidazol-1-yl)-pyrimidin-2-ylamino]-benzamide

Sources & evidence

ORD record
ord-596d08331f5443aea50b975ace38bf36
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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