4-(1-Pyrrolidinyl)piperidine → [1-[3-[2-(4-Chlorophenyl)ethenyl]phenyl]-3,5-diethylpyrazol-4-yl]-(4-pyrrolidin-1-ylpiperidin-1-yl)methanone

반응식

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

참가 물질

반응물 2

HCID 787034-(1-Pyrrolidinyl)piperidine

HCID 673139781-[3-[2-(4-Chlorophenyl)ethenyl]phenyl]-3,5-diethylpyrazole-4-carboxylic acid

생성물 1

HCID 67315562[1-[3-[2-(4-Chlorophenyl)ethenyl]phenyl]-3,5-diethylpyrazol-4-yl]-(4-pyrrolidin-1-ylpiperidin-1-yl)methanone

출처 및 근거

ORD 기록: ord-9687500775134aed94f60c45339e738f
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D

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