1-Phenyl-3-(trifluoromethyl)-1H-pyrazole-4-carboxylic acid → 1-phenyl-3-trifluoromethyl-1H-pyrazole-4-carboxylic acid {6-[(2-methoxy-ethyl)-methyl-amino]-pyridin-3-yl}-amide

반응식

[CH3:19][O:20][CH2:21][CH2:22][N:23]([c:24]1[n:25][cH:26][c:27]([NH2:30])[cH:28][cH:29]1)[CH3:31].[c:1]1(-[n:7]2[n:8][c:9]([C:15]([F:16])([F:17])[F:18])[c:10]([C:12](=[O:13])[OH:14])[cH:11]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1(-[n:7]2[n:8][c:9]([C:15]([F:16])([F:17])[F:18])[c:10]([C:12](=[O:14])[NH:30][c:27]3[cH:26][n:25][c:24]([N:23]([CH2:22][CH2:21][O:20][CH3:19])[CH3:31])[cH:29][cH:28]3)[cH:11]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1

참가 물질

반응물 2

HCID 149682451-Phenyl-3-(trifluoromethyl)-1H-pyrazole-4-carboxylic acid

HCID 52937159N2-(2-methoxyethyl)-N2-methylpyridine-2,5-diamine

생성물 1

HCID 593013631-phenyl-3-trifluoromethyl-1H-pyrazole-4-carboxylic acid {6-[(2-methoxy-ethyl)-methyl-amino]-pyridin-3-yl}-amide

출처 및 근거

ORD 기록: ord-bdab11310afc43bba9ecf971ca9dd7f2
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D

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