Hydrochloric Acid → 4-(1-methylpiperidin-4-ylidenemethyl)-3-trifluoromethyl-N-{4-methyl-3-[4-(3-pyridyl)pyrimidin-2-ylamino]phenyl}benzamide

HRID 1151050Notes

Reaction equation

HRID 1151050 reaction equation
[CH3:1][c:2]1[c:3]([NH:9][c:10]2[n:11][cH:12][cH:13][c:14](-[c:16]3[cH:17][n:18][cH:19][cH:20][cH:21]3)[n:15]2)[cH:4][c:5]([NH2:6])[cH:7][cH:8]1.[CH3:23][N:24]1[CH2:25][CH2:26][C:27](=[CH:30][c:31]2[c:32]([C:40]([F:41])([F:42])[F:43])[cH:33][c:34]([C:35](=[O:36])[Cl:37])[cH:38][cH:39]2)[CH2:28][CH2:29]1.[ClH:22]>>[CH3:1][c:2]1[c:3]([NH:9][c:10]2[n:11][cH:12][cH:13][c:14](-[c:16]3[cH:17][n:18][cH:19][cH:20][cH:21]3)[n:15]2)[cH:4][c:5]([NH:6][C:35]([c:34]2[cH:33][c:32]([C:40]([F:41])([F:42])[F:43])[c:31]([CH:30]=[C:27]3[CH2:26][CH2:25][N:24]([CH3:23])[CH2:29][CH2:28]3)[cH:39][cH:38]2)=[O:36])[cH:7][cH:8]1

Participants

4

Reactant 3

HCID 313Hydrochloric AcidHCID 9965429Imatinib amineHCID 23145988HCID 23145988, compound

Product 1

HCID 112383194-(1-methylpiperidin-4-ylidenemethyl)-3-trifluoromethyl-N-{4-methyl-3-[4-(3-pyridyl)pyrimidin-2-ylamino]phenyl}benzamide

Sources & evidence

ORD record
ord-1d312790c9a347feb6cbfb69cac9e3e0
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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