반응식
[CH3:13][S:14]([O:15][CH2:18][CH2:19][c:20]1[s:21][cH:22][cH:23][cH:24]1)(=[O:16])=[O:17].[CH3:26][CH2:27][CH2:28][CH2:29][CH2:30][CH3:31].[Cl:3][c:4]1[cH:5][cH:6][c:7]([CH2:8][C:9]#[N:10])[cH:11][cH:12]1.[ClH:25].[H-:1].[Na+:2].[O:32]=[CH:33][N:34]([CH3:35])[CH3:36]>>[Cl:3][c:4]1[cH:5][cH:6][c:7]([CH:8]([C:9]#[N:10])[CH2:18][CH2:19][c:20]2[s:21][cH:22][cH:23][cH:24]2)[cH:11][cH:12]1참가 물질
8
출처 및 근거
- ORD 기록
- ord-e23d159ea5b444c0a26a5f973877514d
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
연결된 노트
불러오는 중…