Hexane → 2-(Benzenesulfonyl)-3-(dimethylamino)prop-2-enenitrile
반응식
[CH3:1][O:2][CH:3]([N:4]([CH3:5])[CH3:6])[O:7][CH3:8].[CH3:21][CH2:22][CH2:23][CH2:24][CH2:25][CH3:26].[c:9]1([S:15](=[O:16])(=[O:17])[CH2:18][C:19]#[N:20])[cH:10][cH:11][cH:12][cH:13][cH:14]1>>[CH:3]([N:4]([CH3:5])[CH3:6])=[C:18]([S:15]([c:9]1[cH:10][cH:11][cH:12][cH:13][cH:14]1)(=[O:16])=[O:17])[C:19]#[N:20]참가 물질
4
출처 및 근거
- ORD 기록
- ord-85a667a454c242e4acedfa64a17901b2
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
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