Dichloromethane → N-[(2-amino-1,3-thiazol-5-yl)-(2-chloro-4-fluorophenyl)methyl]-2-methylpropane-2-sulfinamide

반응식

[Cl:1][c:2]1[c:3]([CH:9]([c:10]2[cH:11][n:12][c:13]([NH:15][C:16](=[O:17])[O:18][C:19]([CH3:20])([CH3:21])[CH3:22])[s:14]2)[NH:23][S:24](=[O:25])[C:26]([CH3:27])([CH3:28])[CH3:29])[cH:4][cH:5][c:6]([F:8])[cH:7]1.[Cl:37][CH2:38][Cl:39].[F:30][C:31]([F:32])([F:33])[C:34]([OH:35])=[O:36]>>[Cl:1][c:2]1[c:3]([CH:9]([c:10]2[cH:11][n:12][c:13]([NH2:15])[s:14]2)[NH:23][S:24](=[O:25])[C:26]([CH3:27])([CH3:28])[CH3:29])[cH:4][cH:5][c:6]([F:8])[cH:7]1

참가 물질

반응물 3

HCID 6344Dichloromethane

HCID 6422Trifluoroacetic acid

HCID 72554024tert-butyl N-[5-[(tert-butylsulfinylamino)-(2-chloro-4-fluorophenyl)methyl]-1,3-thiazol-2-yl]carbamate

생성물 1

HCID 76672737N-[(2-amino-1,3-thiazol-5-yl)-(2-chloro-4-fluorophenyl)methyl]-2-methylpropane-2-sulfinamide

출처 및 근거

ORD 기록: ord-a07ebb466bdb4a0b915973559fe1997c
출처 데이터셋: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D

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