1-Chloro-4-isothiocyanato-2-(trifluoromethyl)benzene → 1-[4-(4-Ethoxycarbonyl-2-quinolylthio)phenyl]-3-(4-chloro-3-trifluoromethylphenyl)thiourea
반응식
[Cl:24][c:25]1[c:26]([C:34]([F:35])([F:36])[F:37])[cH:27][c:28]([N:31]=[C:32]=[S:33])[cH:29][cH:30]1.[NH2:1][c:2]1[cH:3][cH:4][c:5]([S:8][c:9]2[n:10][c:11]3[cH:12][cH:13][cH:14][cH:15][c:16]3[c:17]([C:19](=[O:20])[O:21][CH2:22][CH3:23])[cH:18]2)[cH:6][cH:7]1>>[NH:1]([c:2]1[cH:3][cH:4][c:5]([S:8][c:9]2[n:10][c:11]3[cH:12][cH:13][cH:14][cH:15][c:16]3[c:17]([C:19](=[O:20])[O:21][CH2:22][CH3:23])[cH:18]2)[cH:6][cH:7]1)[C:32]([NH:31][c:28]1[cH:27][c:26]([C:34]([F:35])([F:36])[F:37])[c:25]([Cl:24])[cH:30][cH:29]1)=[S:33]참가 물질
3
출처 및 근거
- ORD 기록
- ord-9341665597a44e0ab825cde05b1c0701
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
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