3-Amino-4-fluorophenol → 2-(2-chloro-4-fluorobenzyl)-N-(2-fluoro-5-hydroxyphenyl)-3-oxobutyramide

반응식

[C:10]([S:11][C:15]([CH:16]([C:17]([CH3:18])=[O:19])[CH2:20][c:21]1[c:22]([Cl:28])[cH:23][c:24]([F:27])[cH:25][cH:26]1)=[O:29])([CH3:12])([CH3:13])[CH3:14].[NH2:1][c:2]1[cH:3][c:4]([OH:9])[cH:5][cH:6][c:7]1[F:8]>>[NH:1]([c:2]1[cH:3][c:4]([OH:9])[cH:5][cH:6][c:7]1[F:8])[C:15]([CH:16]([C:17]([CH3:18])=[O:19])[CH2:20][c:21]1[c:22]([Cl:28])[cH:23][c:24]([F:27])[cH:25][cH:26]1)=[O:29]

참가 물질

반응물 2

HCID 135191803-Amino-4-fluorophenol

HCID 866314542-(2-chloro-4-fluorobenzyl)-3-oxothiobutyric acid S-tert-butyl Ester

생성물 1

HCID 866314552-(2-chloro-4-fluorobenzyl)-N-(2-fluoro-5-hydroxyphenyl)-3-oxobutyramide

출처 및 근거

ORD 기록: ord-319bdd481d4b4c89a1f234114dc6edd5
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D

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