홈MCP워크벤치Skills
홈워크벤치알림마이페이지
llms.txt · MCP 가이드개인정보처리방침 · 이용약관 · 지원v1.8.0
  1. 홈
  2. /반응

4-Toluenesulfonyl chloride → 2-[(2-tert-Butyl-1,1-dioxido-3-oxo-5-phenyl-2,3-dihydroisothiazol-4-yl)amino]ethyl 4-methylbenzenesulfonate

HRID 114379
노트
인쇄 미리보기

반응식

HRID 114379 반응식
[C:34]([CH3:35])([CH3:36])([CH3:37])[N:38]1[S:39](=[O:54])(=[O:55])[C:40]([c:48]2[cH:49][cH:50][cH:51][cH:52][cH:53]2)=[C:41]([NH:44][CH2:45][CH2:46][OH:47])[C:42]1=[O:43].[CH3:1][c:2]1[cH:3][cH:4][c:5]([S:8](=[O:9])(=[O:10])[O:11][CH2:12][CH2:13][CH2:14][NH:15][C:16]2=[C:27]([c:28]3[cH:29][cH:30][cH:31][cH:32][cH:33]3)[S:24](=[O:25])(=[O:26])[N:19]([C:20]([CH3:21])([CH3:22])[CH3:23])[C:17]2=[O:18])[cH:6][cH:7]1.[CH3:56][c:57]1[cH:58][cH:59][c:60]([S:61]([Cl:62])(=[O:63])=[O:64])[cH:65][cH:66]1>>[CH3:1][c:2]1[cH:3][cH:4][c:5]([S:8](=[O:9])(=[O:10])[O:47][CH2:46][CH2:45][NH:44][C:41]2=[C:40]([c:48]3[cH:49][cH:50][cH:51][cH:52][cH:53]3)[S:39](=[O:54])(=[O:55])[N:38]([C:34]([CH3:35])([CH3:36])[CH3:37])[C:42]2=[O:43])[cH:6][cH:7]1
참가 물질출처 및 근거반응 노트

참가 물질

4

반응물 3

HCID 73974-Toluenesulfonyl chlorideHCID 672439862-tert-butyl-4-[(2-hydroxyethyl)amino]-5-phenylisothiazol-3(2H)-one 1,1-dioxideHCID 866258673-[(2-Tert-butyl-1,1-dioxido-3-oxo-5-phenyl-2,3-dihydroisothiazol-4-yl)amino]propyl 4-methylbenzenesulfonate

생성물 1

HCID 866258662-[(2-tert-Butyl-1,1-dioxido-3-oxo-5-phenyl-2,3-dihydroisothiazol-4-yl)amino]ethyl 4-methylbenzenesulfonate

출처 및 근거

ORD 기록
ord-3726008a5875435b9464edc934d30d8f
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

반응 노트

불러오는 중…

이 페이지에서참가 물질출처 및 근거반응 노트