Hydrogen Bromide → 2,4-Dichloro-N-(5,5-dimethyl-7-oxo-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-6-methylbenzenesulfonamide

반응식

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

참가 물질

반응물 3

HCID 260Hydrogen Bromide

HCID 5878742-Amino-5,5-dimethyl-5,6-dihydro-4H-benzothiazol-7-one

HCID 28013872,4-Dichloro-6-methylbenzenesulfonyl chloride

생성물 1

HCID 98449732,4-Dichloro-N-(5,5-dimethyl-7-oxo-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-6-methylbenzenesulfonamide

출처 및 근거

ORD 기록: ord-a7237b8eea6144609352ea4b79c516c2
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D

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