6-(2,4-difluorophenyl)-2-isobutyl-4-methanesulfonyloxym ethyl-2H-pyridazin-3-one → 4-carboxy-2-cyclopentylmethyl-6-(3-fluoro-4-methoxyphenyl)-2H-pyridazin-3-one

반응식

[CH:26]1([CH2:31][n:32]2[n:33][c:34](-[c:43]3[cH:44][c:45]([F:51])[c:46]([O:49][CH3:50])[cH:47][cH:48]3)[cH:35][c:36]([C:39](=[O:40])[O:41][CH3:42])[c:37]2=[O:38])[CH2:27][CH2:28][CH2:29][CH2:30]1.[F:1][c:2]1[cH:3][c:4]([F:5])[cH:6][cH:7][c:8]1-[c:9]1[cH:10][c:11]([CH2:12][O:13][S:14]([CH3:15])(=[O:16])=[O:17])[c:18](=[O:19])[n:20]([CH2:21][CH:22]([CH3:23])[CH3:24])[n:25]1>>[CH:26]1([CH2:31][n:32]2[n:33][c:34](-[c:43]3[cH:44][c:45]([F:51])[c:46]([O:49][CH3:50])[cH:47][cH:48]3)[cH:35][c:36]([C:39](=[O:40])[OH:41])[c:37]2=[O:38])[CH2:27][CH2:28][CH2:29][CH2:30]1

참가 물질

반응물 2

HCID 219914166-(2,4-difluorophenyl)-2-isobutyl-4-methanesulfonyloxym ethyl-2H-pyridazin-3-one

HCID 219916512-cyclopentylmethyl-6-(3-fluoro-4-methoxyphenyl)-4-methoxycarbonyl-2H-pyridazin-3-one

생성물 1

HCID 219916014-carboxy-2-cyclopentylmethyl-6-(3-fluoro-4-methoxyphenyl)-2H-pyridazin-3-one

출처 및 근거

ORD 기록: ord-6a5e393af61a4631baec801f9369dbef
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D

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