1,5-dimethyl-1H-pyrazole-3-carboxylic acid → 1,5-Dimethyl-N-(3-{2-[4-(2-methyl-5-quinolinyl)-1-piperazinyl]ethyl}phenyl)-1H-pyrazole-3-carboxamide

HRID 92098

반응식

HRID 92098 반응식
[CH3:1][c:2]1[n:3][c:4]2[cH:5][cH:6][cH:7][c:8]([N:12]3[CH2:13][CH2:14][N:15]([CH2:18][CH2:19][c:20]4[cH:21][c:22]([NH2:23])[cH:24][cH:25][cH:26]4)[CH2:16][CH2:17]3)[c:9]2[cH:10][cH:11]1.[CH3:27][n:28]1[n:29][c:30]([C:34](=[O:35])[OH:36])[cH:31][c:32]1[CH3:33]>>[CH3:1][c:2]1[n:3][c:4]2[cH:5][cH:6][cH:7][c:8]([N:12]3[CH2:13][CH2:14][N:15]([CH2:18][CH2:19][c:20]4[cH:21][c:22]([NH:23][C:34]([c:30]5[n:29][n:28]([CH3:27])[c:32]([CH3:33])[cH:31]5)=[O:35])[cH:24][cH:25][cH:26]4)[CH2:16][CH2:17]3)[c:9]2[cH:10][cH:11]1

참가 물질

3

반응물 2

HCID 5877571,5-dimethyl-1H-pyrazole-3-carboxylic acidHCID 498521053-(2-[4-(2-Methyl-5-quinolinyl)-1-piperazinyl]ethyl}aniline

생성물 1

HCID 684266031,5-Dimethyl-N-(3-{2-[4-(2-methyl-5-quinolinyl)-1-piperazinyl]ethyl}phenyl)-1H-pyrazole-3-carboxamide

출처 및 근거

ORD 기록
ord-2df9f8efc7184abe9b4969a4a0935839
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

연결된 노트

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