Hydrochloric Acid → N-[4-Methyl-3-(2-pyridin-4-yl-6-(trifluoromethyl)pyrimidin-4-ylamino)-phenyl]nicotinamide

반응식

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

참가 물질

반응물 3

HCID 313Hydrochloric Acid

HCID 82604Nicotinoyl chloride

HCID 227324584-(5-Amino-2-methylanilino)-2-(4-pyridinyl)-6-(trifluoromethyl)pyrimidine

생성물 1

HCID 22732504N-[4-Methyl-3-(2-pyridin-4-yl-6-(trifluoromethyl)pyrimidin-4-ylamino)-phenyl]nicotinamide

출처 및 근거

ORD 기록: ord-a6dead2cd15c4fa891fa2a83c3f31f2f
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D

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