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

Dimethyl Sulfoxide → 2-Chloro-N-(1-hydroxy-cycloheptylmethyl)-5-[4-(2-methoxy-ethyl)-5-oxo-4,5-dihydro-[1,2,4]triazol-1-yl]-benzamide

HRID 87989
노트
인쇄 미리보기

반응식

HRID 87989 반응식
[C:26](=[O:27])([O-:28])[O-:29].[CH3:32][O:33][CH2:34][CH2:35][Br:36].[CH3:37][S:38]([CH3:39])=[O:40].[Cl:1][c:2]1[c:3]([C:4](=[O:5])[NH:6][CH2:7][C:8]2([OH:15])[CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14]2)[cH:16][c:17](-[n:20]2[n:21][cH:22][nH:23][c:24]2=[O:25])[cH:18][cH:19]1.[Cs+:30].[Cs+:31].[OH2:41]>>[Cl:1][c:2]1[c:3]([C:4](=[O:5])[NH:6][CH2:7][C:8]2([OH:15])[CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14]2)[cH:16][c:17](-[n:20]2[n:21][cH:22][n:23]([CH2:35][CH2:34][O:33][CH3:32])[c:24]2=[O:25])[cH:18][cH:19]1
참가 물질출처 및 근거반응 노트

참가 물질

7

반응물 6

HCID 679Dimethyl SulfoxideHCID 962WaterHCID 19660Carbonate IonHCID 809722-Bromoethyl methyl etherHCID 104967Cesium cation2회HCID 135492557HCID 135492557, 화합물

생성물 1

HCID 9932047
2-Chloro-N-(1-hydroxy-cycloheptylmethyl)-5-[4-(2-methoxy-ethyl)-5-oxo-4,5-dihydro-[1,2,4]triazol-1-yl]-benzamide

출처 및 근거

ORD 기록
ord-668af0d764ef43489a4c89387f66c4c5
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