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

Potassium Cation → 3-{3-[2-Chloro-6-(4-methoxy-benzylamino)-pyridin-4-ylmethyl]-5-isopropyl-2,6-dioxo-1,2,3,6-tetrahydro-pyrimidin-4-yloxy}-5-methyl-benzonitrile

HRID 1238588
노트
인쇄 미리보기

반응식

HRID 1238588 반응식
[C:53](=[O:54])([O-:55])[O-:56].[CH3:20][CH2:21][N:22]([CH2:23][CH3:24])[CH2:25][CH3:26].[CH3:27][S:28](=[O:29])(=[O:30])[Cl:31].[CH:32]([CH3:33])([CH3:34])[c:35]1[c:36]([O:43][c:44]2[cH:45][c:46]([C:47]#[N:48])[cH:49][c:50]([CH3:52])[cH:51]2)[nH:37][c:38](=[O:42])[nH:39][c:40]1=[O:41].[CH:61]([Cl:62])([Cl:63])[Cl:64].[Cl:1][c:2]1[n:3][c:4]([NH:10][CH2:11][c:12]2[cH:13][cH:14][c:15]([O:18][CH3:19])[cH:16][cH:17]2)[cH:5][c:6]([CH2:8][OH:9])[cH:7]1.[Cl:65][CH2:66][Cl:67].[I-:59].[K+:57].[K+:58].[Li+:60].[O:68]=[CH:69][N:70]([CH3:71])[CH3:72]>>[Cl:1][c:2]1[n:3][c:4]([NH:10][CH2:11][c:12]2[cH:13][cH:14][c:15]([O:18][CH3:19])[cH:16][cH:17]2)[cH:5][c:6]([CH2:8][n:37]2[c:36]([O:43][c:44]3[cH:45][c:46]([C:47]#[N:48])[cH:49][c:50]([CH3:52])[cH:51]3)[c:35]([CH:32]([CH3:33])[CH3:34])[c:40](=[O:41])[nH:39][c:38]2=[O:42])[cH:7]1
참가 물질출처 및 근거반응 노트

참가 물질

12

반응물 11

HCID 813Potassium Cation2회HCID 6212ChloroformHCID 6228DimethylformamideHCID 6344DichloromethaneHCID 8471TriethylamineHCID 19660Carbonate IonHCID 28486Lithium ionHCID 30165Iodide Ion
HCID 31297Methanesulfonyl chloride
HCID 591847142-Chloro-6-(p-methoxybenzylamino)-4-pyridinemethanol
HCID 596868373-(5-Isopropyl-2,6-dioxo-1,2,3,6-tetrahydro-pyrimidin-4-yloxy)-5-methyl-benzonitrile

생성물 1

HCID 596868493-{3-[2-Chloro-6-(4-methoxy-benzylamino)-pyridin-4-ylmethyl]-5-isopropyl-2,6-dioxo-1,2,3,6-tetrahydro-pyrimidin-4-yloxy}-5-methyl-benzonitrile

출처 및 근거

ORD 기록
ord-8c8626b40cb44b8aaf81a706bb23229a
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI
10.1039/C8SC04228D

반응 노트

불러오는 중…

이 페이지에서참가 물질출처 및 근거반응 노트