Toluene → 2-Ethyl-4-cyanophenyl isothiocyanate
반응식
[CH3:16][c:17]1[cH:18][cH:19][cH:20][cH:21][cH:22]1.[Cl:12][C:13]([Cl:14])=[S:15].[NH2:1][c:2]1[c:3]([CH2:10][CH3:11])[cH:4][c:5]([C:6]#[N:7])[cH:8][cH:9]1>>[N:1]([c:2]1[c:3]([CH2:10][CH3:11])[cH:4][c:5]([C:6]#[N:7])[cH:8][cH:9]1)=[C:13]=[S:15]참가 물질
4
출처 및 근거
- ORD 기록
- ord-8523c4734418441fa4a436b468337d81
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
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