Ethyl isothiocyanate → BM 20
반응식
[CH2:20]([CH3:21])[N:22]=[C:23]=[S:24].[CH:1]1([NH:9][c:10]2[c:11]([S:16](=[O:17])(=[O:18])[NH2:19])[cH:12][n:13][cH:14][cH:15]2)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8]1>>[CH:1]1([NH:9][c:10]2[c:11]([S:16](=[O:17])(=[O:18])[NH:19][C:23]([NH:22][CH2:20][CH3:21])=[S:24])[cH:12][n:13][cH:14][cH:15]2)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8]1참가 물질
3
출처 및 근거
- ORD 기록
- ord-a1b37f1d7f554b82b8f5305c61cd042a
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
반응 노트
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