5-Cyclohexyl-2-methoxyaniline → 4-[(5-cyclohexyl-2-methoxyphenyl)amino]-2-(2-methoxyethyl)-5-phenylisothiazol-3(2H)-one 1,1-dioxide

반응식

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

참가 물질

반응물 2

HCID 27579915-Cyclohexyl-2-methoxyaniline

HCID 672439094-Chloro-2-(2-methoxyethyl)-5-phenylisothiazol-3(2H)-one 1,1-dioxide

생성물 1

HCID 114964874-[(5-cyclohexyl-2-methoxyphenyl)amino]-2-(2-methoxyethyl)-5-phenylisothiazol-3(2H)-one 1,1-dioxide

출처 및 근거

ORD 기록: ord-b1790272ad1f4e19a473924468ec82bd
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

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