Benzene, 1-iodo-2-(trifluoromethyl)- → (4-Amino-2-ethylsulfanyl-pyrimidin-5-yl)-(2-trifluoromethyl-phenyl)-methanone

HRID 2148110

반응식

HRID 2148110 반응식
[CH3:1][O:2][N:3]([C:4](=[O:5])[c:6]1[c:7]([NH2:15])[n:8][c:9]([S:12][CH2:13][CH3:14])[n:10][cH:11]1)[CH3:16].[F:17][C:18]([c:19]1[c:20]([Li:25])[cH:21][cH:22][cH:23][cH:24]1)([F:26])[F:27].[I:28][c:29]1[cH:30][cH:31][cH:32][cH:33][c:34]1[C:35]([F:36])([F:37])[F:38]>>[C:4](=[O:5])([c:6]1[c:7]([NH2:15])[n:8][c:9]([S:12][CH2:13][CH3:14])[n:10][cH:11]1)[c:20]1[c:19]([C:18]([F:17])([F:26])[F:27])[cH:24][cH:23][cH:22][cH:21]1

참가 물질

4

반응물 3

HCID 67957Benzene, 1-iodo-2-(trifluoromethyl)-HCID 119748325-Pyrimidinecarboxamide, 4-amino-2-(ethylthio)-N-methoxy-N-methyl-HCID 1785066832-(Trifluoromethyl)phenyllithium

생성물 1

HCID 21070577(4-Amino-2-ethylsulfanyl-pyrimidin-5-yl)-(2-trifluoromethyl-phenyl)-methanone

출처 및 근거

ORD 기록
ord-fba5f759f97f4276a5ad3b1e15a942f3
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

연결된 노트

불러오는 중…