반응식
[Br:2][c:3]1[cH:4][c:5]2[c:10]([cH:11][cH:12]1)[O:9][C:8]1([CH2:7][C:6]2=[N:18][S:19]([C:20]([CH3:21])([CH3:22])[CH3:23])=[O:24])[CH2:13][O:14][CH2:15][CH2:16][CH2:17]1.[CH2:25]1[O:26][CH2:27][CH2:28][O:29][CH2:30]1.[ClH:1]>>[Br:2][c:3]1[cH:4][c:5]2[c:10]([cH:11][cH:12]1)[O:9][C:8]1([CH2:7][C:6]2=[NH:18])[CH2:13][O:14][CH2:15][CH2:16][CH2:17]1참가 물질
4
출처 및 근거
- ORD 기록
- ord-2c4e57f54777493da826a6604384268f
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
연결된 노트
불러오는 중…