반응식
[NH2:1][C:2]([C:3]#[N:4])([CH2:5][n:6]1[n:7][c:8]2[c:9]([n:10]1)[cH:11][cH:12][cH:13][c:14]2[Cl:15])[CH3:16].[O:17]([c:18]1[cH:19][cH:20][cH:21][cH:22][cH:23]1)[c:24]1[cH:25][cH:26][c:27]([C:28](=[O:29])[Cl:30])[cH:31][cH:32]1>>[NH:1]([C:2]([C:3]#[N:4])([CH2:5][n:6]1[n:7][c:8]2[c:9]([n:10]1)[cH:11][cH:12][cH:13][c:14]2[Cl:15])[CH3:16])[C:28]([c:27]1[cH:26][cH:25][c:24]([O:17][c:18]2[cH:19][cH:20][cH:21][cH:22][cH:23]2)[cH:32][cH:31]1)=[O:29]참가 물질
3
출처 및 근거
- ORD 기록
- ord-cd88b7f6270b408cab267dc20d2a02bc
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
연결된 노트
불러오는 중…