Methanol → 5-(2-hydroxy-phenyl)-1H-pyrazole-3-carboxylic acid {2-[4-(2-chloro-phenylamino)-piperidin-1-yl]-2-oxo-ethyl}-amide

반응식

[CH3:42][OH:43].[Cl:1][c:2]1[c:3]([NH:8][CH:9]2[CH2:10][CH2:11][N:12]([C:15]([CH2:16][NH:17][C:18](=[O:19])[c:20]3[n:21][nH:22][c:23](-[c:25]4[c:26]([O:31][CH2:32][c:33]5[cH:34][cH:35][cH:36][cH:37][cH:38]5)[cH:27][cH:28][cH:29][cH:30]4)[cH:24]3)=[O:39])[CH2:13][CH2:14]2)[cH:4][cH:5][cH:6][cH:7]1.[H:40][H:41]>>[Cl:1][c:2]1[c:3]([NH:8][CH:9]2[CH2:10][CH2:11][N:12]([C:15]([CH2:16][NH:17][C:18](=[O:19])[c:20]3[n:21][nH:22][c:23](-[c:25]4[c:26]([OH:31])[cH:27][cH:28][cH:29][cH:30]4)[cH:24]3)=[O:39])[CH2:13][CH2:14]2)[cH:4][cH:5][cH:6][cH:7]1

참가 물질

반응물 3

HCID 887Methanol

HCID 178418361HCID 178418361, 화합물

HCID 178523481HCID 178523481, 화합물

생성물 1

HCID 1785234825-(2-hydroxy-phenyl)-1H-pyrazole-3-carboxylic acid {2-[4-(2-chloro-phenylamino)-piperidin-1-yl]-2-oxo-ethyl}-amide

출처 및 근거

ORD 기록: ord-f6006324e63044e6b47e6d6b2e2b7f11
출처 데이터셋: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D

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