반응식
[Cl:14][c:15]1[c:16]2[c:17]([n:18][cH:19][c:20]1[C:21]#[N:22])[cH:23][c:24](-[c:26]1[cH:27][cH:28][cH:29][cH:30][cH:31]1)[s:25]2.[Cl:1][c:2]1[c:3]([NH2:4])[cH:5][c:6]([O:10][CH3:11])[c:7]([Cl:9])[cH:8]1.[H-:12].[Na+:13].[O:32]1[CH2:33][CH2:34][CH2:35][CH2:36]1>>[Cl:1][c:2]1[c:3]([NH:4][c:15]2[c:16]3[c:17]([n:18][cH:19][c:20]2[C:21]#[N:22])[cH:23][c:24](-[c:26]2[cH:27][cH:28][cH:29][cH:30][cH:31]2)[s:25]3)[cH:5][c:6]([O:10][CH3:11])[c:7]([Cl:9])[cH:8]1참가 물질
6
출처 및 근거
- ORD 기록
- ord-c5959230101346e5be37c493a29742d5
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
연결된 노트
불러오는 중…