반응식
[CH3:26][C:27](=[O:28])[OH:29].[Cl:1][c:2]1[n:3][cH:4][c:5]([CH3:9])[c:6]([NH2:8])[n:7]1.[N:10]1([S:16](=[O:17])(=[O:18])[c:19]2[cH:20][c:21]([NH2:25])[cH:22][cH:23][cH:24]2)[CH2:11][CH2:12][CH2:13][CH2:14][CH2:15]1>>[c:2]1([NH:25][c:21]2[cH:20][c:19]([S:16]([N:10]3[CH2:11][CH2:12][CH2:13][CH2:14][CH2:15]3)(=[O:17])=[O:18])[cH:24][cH:23][cH:22]2)[n:3][cH:4][c:5]([CH3:9])[c:6]([NH2:8])[n:7]1참가 물질
4
출처 및 근거
- ORD 기록
- ord-d1e90b238e774033b09540fe81b41354
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
연결된 노트
불러오는 중…