반응식
[CH2:32]1[O:33][CH2:34][CH2:35][CH2:36]1.[NH2:16][C:17]([C:18]#[N:19])([CH2:20][n:21]1[n:22][c:23]2[c:24]([n:25][cH:26][c:27]([Br:29])[cH:28]2)[cH:30]1)[CH3:31].[c:1]1(-[c:10]2[cH:11][cH:12][cH:13][cH:14][cH:15]2)[cH:2][cH:3][c:4]([C:7](=[O:8])[Cl:9])[cH:5][cH:6]1>>[c:1]1(-[c:10]2[cH:11][cH:12][cH:13][cH:14][cH:15]2)[cH:2][cH:3][c:4]([C:7](=[O:8])[NH:16][C:17]([C:18]#[N:19])([CH2:20][n:21]2[n:22][c:23]3[c:24]([n:25][cH:26][c:27]([Br:29])[cH:28]3)[cH:30]2)[CH3:31])[cH:5][cH:6]1참가 물질
4
출처 및 근거
- ORD 기록
- ord-00bb42c865c5495e854b6fc4461184ee
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
연결된 노트
불러오는 중…