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

Hydrochloric Acid → 5-[3,6-Dihydro-3-methyl-2,6-dioxo-4-(trifluoromethyl)-1(2H)-pyrimidinyl]-1,2-benzisothiazole-3-malononitrile

HRID 195163
노트
인쇄 미리보기

반응식

HRID 195163 반응식
[CH3:29][CH2:30][N:31]([CH2:32][CH3:33])[CH2:34][CH3:35].[CH3:37][S:38]([CH3:39])=[O:40].[Cl:1][c:2]1[n:3][s:4][c:5]2[c:6]1[cH:7][c:8](-[n:11]1[c:12](=[O:23])[n:13]([CH3:22])[c:14]([C:18]([F:19])([F:20])[F:21])[cH:15][c:16]1=[O:17])[cH:9][cH:10]2.[ClH:36].[N:24]#[C:25][CH2:26][C:27]#[N:28].[OH2:41]>>[c:2]1([CH:26]([C:25]#[N:24])[C:27]#[N:28])[n:3][s:4][c:5]2[c:6]1[cH:7][c:8](-[n:11]1[c:12](=[O:23])[n:13]([CH3:22])[c:14]([C:18]([F:19])([F:20])[F:21])[cH:15][c:16]1=[O:17])[cH:9][cH:10]2
참가 물질출처 및 근거반응 노트

참가 물질

7

반응물 6

HCID 313Hydrochloric AcidHCID 679Dimethyl SulfoxideHCID 962WaterHCID 8010MalononitrileHCID 8471TriethylamineHCID 159065613-(3-chloro-1,2-benzisothiazol-5-yl)-1-methyl-6-(trifluoromethyl)-2,4(1H,3H)-pyrimidinedione

생성물 1

출처 및 근거

ORD 기록
ord-32a8e23b36a34c8495108c182428caf1
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI
10.1039/C8SC04228D

반응 노트

불러오는 중…

이 페이지에서참가 물질출처 및 근거반응 노트
HCID 22119818
5-[3,6-Dihydro-3-methyl-2,6-dioxo-4-(trifluoromethyl)-1(2H)-pyrimidinyl]-1,2-benzisothiazole-3-malononitrile