반응식
[CH3:30][CH:31]([OH:32])[CH3:33].[Cl:1][c:2]1[n:3][c:4]2[cH:5][c:6]([O:12][CH3:13])[cH:7][cH:8][c:9]2[cH:10][n:11]1.[O:14]1[CH2:15][CH2:16][N:17]([S:20](=[O:21])(=[O:22])[c:23]2[cH:24][cH:25][c:26]([NH2:27])[cH:28][cH:29]2)[CH2:18][CH2:19]1>>[c:2]1([NH:27][c:26]2[cH:25][cH:24][c:23]([S:20]([N:17]3[CH2:16][CH2:15][O:14][CH2:19][CH2:18]3)(=[O:21])=[O:22])[cH:29][cH:28]2)[n:3][c:4]2[cH:5][c:6]([O:12][CH3:13])[cH:7][cH:8][c:9]2[cH:10][n:11]1참가 물질
4
출처 및 근거
- ORD 기록
- ord-6e5fbe96cfe1434fbe6f171373ab4f1e
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
연결된 노트
불러오는 중…