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

Acetone → 4-Carbamoylthio-1,2-bis-(3-methoxycarbonyl-2-thioureido)-benzene

HRID 183115
노트
인쇄 미리보기

반응식

HRID 183115 반응식
[C:15]([NH2:16])(=[O:17])[S:18][c:19]1[cH:20][c:21]([N+:33]([O-:34])=[O:35])[c:22]([NH:25][C:26](=[S:27])[NH:28][C:29](=[O:30])[O:31][CH3:32])[cH:23][cH:24]1.[CH3:48][O:49][C:50](=[O:51])[N:52]=[C:53]=[S:54].[CH3:56][C:57](=[O:58])[CH3:59].[Fe:55].[NH2:1][c:2]1[cH:3][cH:4][c:5]([S:6][C:7](=[O:8])[NH2:9])[cH:10][c:11]1[N+:12]([O-:13])=[O:14].[NH2:36][c:37]1[cH:38][cH:39][c:40]([S:41][C:42](=[O:43])[NH2:44])[cH:45][c:46]1[NH2:47]>>[C:15]([NH2:16])(=[O:17])[S:18][c:19]1[cH:20][c:21]([NH:33][C:53]([NH:52][C:50]([O:49][CH3:48])=[O:51])=[S:54])[c:22]([NH:25][C:26](=[S:27])[NH:28][C:29](=[O:30])[O:31][CH3:32])[cH:23][cH:24]1
참가 물질출처 및 근거반응 노트

참가 물질

7

반응물 6

HCID 180AcetoneHCID 23925IronHCID 552246Methoxycarbonyl isothiocyanateHCID 189497711-Amino-4-carbamoylthio-2-nitrobenzeneHCID 203711621,2-Diamino-4-carbamoylthiobenzeneHCID 203711724-Carbamoylthio-1-(3-methoxycarbonyl-2-thioureido)-2-nitrobenzene

생성물 1

HCID 20371224
4-Carbamoylthio-1,2-bis-(3-methoxycarbonyl-2-thioureido)-benzene

출처 및 근거

ORD 기록
ord-9f333d6caef24dcfac00f59cd21be2ce
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