반응식
[CH3:23][CH2:24][O:25][CH2:26][CH3:27].[N+:12](=[O:13])([O-:14])[c:15]1[c:16]([S:21][Cl:22])[cH:17][cH:18][cH:19][cH:20]1.[nH:1]1[cH:2][cH:3][c:4]2[cH:5][cH:6][c:7]([C:10]#[N:11])[cH:8][c:9]12>>[nH:1]1[cH:2][c:3]([S:21][c:16]2[c:15]([N+:12](=[O:13])[O-:14])[cH:20][cH:19][cH:18][cH:17]2)[c:4]2[cH:5][cH:6][c:7]([C:10]#[N:11])[cH:8][c:9]12참가 물질
4
출처 및 근거
- ORD 기록
- ord-fbb253fc0644474d8ca807ac9e28df95
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
연결된 노트
불러오는 중…