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

HRID 108226

반응식

HRID 108226 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].[I:17][c:18]1[c:19]([C:24]([F:25])([F:26])[F:27])[cH:20][cH:21][cH:22][cH:23]1>>[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:18]1[c:19]([C:24]([F:25])([F:26])[F:27])[cH:20][cH:21][cH:22][cH:23]1

참가 물질

3

반응물 2

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

생성물 1

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

출처 및 근거

ORD 기록
ord-e8cf572ecee241e38a19b6e463d55f07
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

연결된 노트

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