1-Butanesulfonyl chloride → N-[6-[2-(butylsulfonylamino)ethoxy]-5-(2-methoxyphenoxy)-2-(trifluoromethyl)pyrimidin-4-yl]-5-propan-2-ylpyridine-2-sulfonamide

반응식

[CH2:37]([CH2:38][CH2:39][CH3:40])[S:41](=[O:42])(=[O:43])[Cl:44].[CH:1]([CH3:2])([CH3:3])[c:4]1[cH:5][cH:6][c:7]([S:10](=[O:11])(=[O:12])[NH:13][c:14]2[n:15][c:16]([C:33]([F:34])([F:35])[F:36])[n:17][c:18]([O:29][CH2:30][CH2:31][NH2:32])[c:19]2[O:20][c:21]2[c:22]([O:27][CH3:28])[cH:23][cH:24][cH:25][cH:26]2)[n:8][cH:9]1>>[CH:1]([CH3:2])([CH3:3])[c:4]1[cH:5][cH:6][c:7]([S:10](=[O:11])(=[O:12])[NH:13][c:14]2[n:15][c:16]([C:33]([F:34])([F:35])[F:36])[n:17][c:18]([O:29][CH2:30][CH2:31][NH:32][S:41]([CH2:37][CH2:38][CH2:39][CH3:40])(=[O:42])=[O:43])[c:19]2[O:20][c:21]2[c:22]([O:27][CH3:28])[cH:23][cH:24][cH:25][cH:26]2)[n:8][cH:9]1

참가 물질

반응물 2

HCID 754301-Butanesulfonyl chloride

HCID 18184237N-[6-(2-aminoethoxy)-5-(2-methoxyphenoxy)-2-(trifluoromethyl)pyrimidin-4-yl]-5-propan-2-ylpyridine-2-sulfonamide

생성물 1

HCID 18184221N-[6-[2-(butylsulfonylamino)ethoxy]-5-(2-methoxyphenoxy)-2-(trifluoromethyl)pyrimidin-4-yl]-5-propan-2-ylpyridine-2-sulfonamide

출처 및 근거

ORD 기록: ord-d928a349e0fd4c18963552fb485d2a3d
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D

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