1-Chloro-4-isothiocyanato-2-(trifluoromethyl)benzene → 1-[4-(4-Quinolylthio)phenyl]-3-(4-chloro-3-trifluoromethylphenyl)thiourea
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[Cl:19][c:20]1[c:21]([C:29]([F:30])([F:31])[F:32])[cH:22][c:23]([N:26]=[C:27]=[S:28])[cH:24][cH:25]1.[NH2:1][c:2]1[cH:3][cH:4][c:5]([S:8][c:9]2[cH:10][cH:11][n:12][c:13]3[cH:14][cH:15][cH:16][cH:17][c:18]23)[cH:6][cH:7]1>>[NH:1]([c:2]1[cH:3][cH:4][c:5]([S:8][c:9]2[cH:10][cH:11][n:12][c:13]3[cH:14][cH:15][cH:16][cH:17][c:18]23)[cH:6][cH:7]1)[C:27]([NH:26][c:23]1[cH:22][c:21]([C:29]([F:30])([F:31])[F:32])[c:20]([Cl:19])[cH:25][cH:24]1)=[S:28]참가 물질
3
출처 및 근거
- ORD 기록
- ord-4936ae292aef405ebb0ab02cb33146f3
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
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