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

Ethanol → 4-(Pyrrolidin-1-yl)piperidine-1-carboxylic acid {4-[3-fluoro-4-(3-phenylacetylthioureido)phenoxy]pyridin-2-yl}amide

HRID 1556553
노트
인쇄 미리보기

반응식

HRID 1556553 반응식
[C:30]12([CH2:31][S:32]([OH:33])(=[O:34])=[O:35])[C:36]([CH3:37])([CH3:38])[CH:39]([CH2:40][CH2:41]1)[CH2:42][C:43]2=[O:44].[CH3:57][CH2:58][O:59][CH2:60][CH3:61].[CH3:62][CH2:63][OH:64].[CH3:65][c:66]1[cH:67][cH:68][cH:69][cH:70][cH:71]1.[CH3:72][CH2:73][CH2:74][CH2:75][CH2:76][CH3:77].[NH2:1][c:2]1[c:3]([F:29])[cH:4][c:5]([O:6][c:7]2[cH:8][c:9]([NH:13][C:14](=[O:15])[N:16]3[CH2:17][CH2:18][CH:19]([N:22]4[CH2:23][CH2:24][CH2:25][CH2:26]4)[CH2:20][CH2:21]3)[n:10][cH:11][cH:12]2)[cH:27][cH:28]1.[c:45]1([CH2:51][C:52](=[O:53])[N:54]=[C:55]=[S:56])[cH:46][cH:47][cH:48][cH:49][cH:50]1>>[NH:1]([c:2]1[c:3]([F:29])[cH:4][c:5]([O:6][c:7]2[cH:8][c:9]([NH:13][C:14](=[O:15])[N:16]3[CH2:17][CH2:18][CH:19]([N:22]4[CH2:23][CH2:24][CH2:25][CH2:26]4)[CH2:20][CH2:21]3)[n:10][cH:11][cH:12]2)[cH:27][cH:28]1)[C:55]([NH:54][C:52]([CH2:51][c:45]1[cH:46][cH:47][cH:48][cH:49][cH:50]1)=[O:53])=[S:56]
참가 물질출처 및 근거반응 노트

참가 물질

8

반응물 7

HCID 702EthanolHCID 1140TolueneHCID 3283Diethyl EtherHCID 8058HexaneHCID 18462Bicyclo[2.2.1]heptane-1-methanesulfonic acid, 7,7-dimethyl-2-oxo-, (1S)-HCID 12454157Phenylacetyl isothiocyanateHCID 576775624-(Pyrrolidin-1-yl)piperidine-1-carboxylic acid [4-(4-amino-3-fluorophenoxy)pyridin-2-yl]amide

생성물 1

HCID 576773594-(Pyrrolidin-1-yl)piperidine-1-carboxylic acid {4-[3-fluoro-4-(3-phenylacetylthioureido)phenoxy]pyridin-2-yl}amide

출처 및 근거

ORD 기록
ord-62a652c536a244a7baad27545fc440d6
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI
10.1039/C8SC04228D

반응 노트

불러오는 중…

이 페이지에서참가 물질출처 및 근거반응 노트