6-Methyl-4-pyridazinecarboxylic acid hydrochloride → N-[(3RS,4SR)-4-(3,4-dichloro-phenyl)-1-(6-methyl-pyridazine-4-carbonyl)-pyrrolidin-3-yl]-2-(4-fluoro-phenyl)-N-methyl-acetamide

반응식

[CH3:26][c:27]1[cH:28][c:29]([C:33](=[O:34])[OH:35])[cH:30][n:31][n:32]1.[Cl:1][c:2]1[cH:3][c:4]([CH:9]2[CH:10]([N:14]([C:15]([CH2:16][c:17]3[cH:18][cH:19][c:20]([F:23])[cH:21][cH:22]3)=[O:24])[CH3:25])[CH2:11][NH:12][CH2:13]2)[cH:5][cH:6][c:7]1[Cl:8]>>[Cl:1][c:2]1[cH:3][c:4]([CH:9]2[CH:10]([N:14]([C:15]([CH2:16][c:17]3[cH:18][cH:19][c:20]([F:23])[cH:21][cH:22]3)=[O:24])[CH3:25])[CH2:11][N:12]([C:33]([c:29]3[cH:28][c:27]([CH3:26])[n:32][n:31][cH:30]3)=[O:34])[CH2:13]2)[cH:5][cH:6][c:7]1[Cl:8]

참가 물질

반응물 2

HCID 553007686-Methyl-4-pyridazinecarboxylic acid hydrochloride

HCID 67025826N-[(3RS,4SR)-4-(3,4-dichloro-phenyl)-pyrrolidin-3-yl]-2-(4-fluoro-phenyl)-N-methyl-acetamide

생성물 1

HCID 67025683N-[(3RS,4SR)-4-(3,4-dichloro-phenyl)-1-(6-methyl-pyridazine-4-carbonyl)-pyrrolidin-3-yl]-2-(4-fluoro-phenyl)-N-methyl-acetamide

출처 및 근거

ORD 기록: ord-9be819bb59ce49dbb32d74d03f9ba4d7
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D

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