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

Sodium Ion → 3-[4-(trifluoromethyl)phenyl]prop-2-enyl 4-[(2-methyl-6-nitro-3H-imidazo[2,1-b][1,3]oxazol-2-yl)methyl]piperazine-1-carboxylate

HRID 2316456
노트
인쇄 미리보기

반응식

HRID 2316456 반응식
[CH3:1][N:2]([CH3:3])[CH:4]=[O:5].[CH3:51][C:52]([CH3:53])([O-:54])[CH3:55].[CH3:58][CH2:59][O:60][C:61](=[O:62])[CH3:63].[N+:6](=[O:7])([O-:8])[c:9]1[n:10][c:11]([S:41][c:42]2[cH:43][cH:44][cH:45][cH:46][c:47]2[N+:48]([O-:49])=[O:50])[n:12]([CH2:14][C:15]([CH2:16][N:17]2[CH2:18][CH2:19][N:20]([C:23](=[O:24])[O:25][CH2:26][CH:27]=[CH:28][c:29]3[cH:30][cH:31][c:32]([C:35]([F:36])([F:37])[F:38])[cH:33][cH:34]3)[CH2:21][CH2:22]2)([CH3:39])[OH:40])[cH:13]1.[Na+:56].[OH2:57]>>[N+:6](=[O:7])([O-:8])[c:9]1[n:10][c:11]2[n:12]([cH:13]1)[CH2:14][C:15]([CH2:16][N:17]1[CH2:18][CH2:19][N:20]([C:23](=[O:24])[O:25][CH2:26][CH:27]=[CH:28][c:29]3[cH:30][cH:31][c:32]([C:35]([F:36])([F:37])[F:38])[cH:33][cH:34]3)[CH2:21][CH2:22]1)([CH3:39])[O:40]2
참가 물질출처 및 근거반응 노트

참가 물질

7

반응물 6

HCID 923Sodium IonHCID 962WaterHCID 6228DimethylformamideHCID 8857Ethyl AcetateHCID 45749132-Methylpropan-2-olateHCID 913684363-[4-(Trifluoromethyl)phenyl]prop-2-enyl 4-[2-hydroxy-2-methyl-3-[4-nitro-2-(2-nitrophenyl)sulfanylimidazol-1-yl]propyl]piperazine-1-carboxylate

생성물 1

HCID 67157282
3-[4-(trifluoromethyl)phenyl]prop-2-enyl 4-[(2-methyl-6-nitro-3H-imidazo[2,1-b][1,3]oxazol-2-yl)methyl]piperazine-1-carboxylate

출처 및 근거

ORD 기록
ord-682db80676c84df29cb95805c4a6787d
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI
10.1039/C8SC04228D

반응 노트

불러오는 중…

이 페이지에서참가 물질출처 및 근거반응 노트