반응식
[C:15]([CH3:16])([CH3:17])([CH3:18])[O:19][C:20](=[O:21])[c:22]1[s:23][c:24]([Br:27])[cH:25][cH:26]1.[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9]([NH:10][CH2:11][C:12]#[CH:13])=[O:14]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9]([NH:10][CH2:11][C:12]#[C:13][c:24]1[s:23][c:22]([C:20]([O:19][C:15]([CH3:16])([CH3:17])[CH3:18])=[O:21])[cH:26][cH:25]1)=[O:14]참가 물질
3
출처 및 근거
- ORD 기록
- ord-63ba041928f943249e57d49c6fbd3fc4
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
연결된 노트
불러오는 중…