Dimethyl Sulfoxide → 5-Bromo-2-(4-chloro-benzenesulfonylamino)-N-(2-trifluoromethoxy-benzyl)-benzamide

반응식

[Br:1][c:2]1[cH:3][cH:4][c:5]([NH:11][S:12](=[O:13])(=[O:14])[c:15]2[cH:16][cH:17][c:18]([Cl:21])[cH:19][cH:20]2)[c:6]([C:7](=[O:8])[Cl:9])[cH:10]1.[CH3:35][S:36]([CH3:37])=[O:38].[F:22][C:23]([O:24][c:25]1[c:26]([CH2:27][NH2:28])[cH:29][cH:30][cH:31][cH:32]1)([F:33])[F:34]>>[Br:1][c:2]1[cH:3][cH:4][c:5]([NH:11][S:12](=[O:13])(=[O:14])[c:15]2[cH:16][cH:17][c:18]([Cl:21])[cH:19][cH:20]2)[c:6]([C:7](=[O:8])[NH:28][CH2:27][c:26]2[c:25]([O:24][C:23]([F:22])([F:33])[F:34])[cH:32][cH:31][cH:30][cH:29]2)[cH:10]1

참가 물질

반응물 3

HCID 679Dimethyl Sulfoxide

HCID 2777251(2-(Trifluoromethoxy)phenyl)methanamine

HCID 219302755-Bromo-2-(4-chloro-benzenesulfonylamino)-benzoyl chloride

생성물 1

HCID 219303005-Bromo-2-(4-chloro-benzenesulfonylamino)-N-(2-trifluoromethoxy-benzyl)-benzamide

출처 및 근거

ORD 기록: ord-1e13b22acf9f472ba2f9b6b8b97da2ef
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D

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