반응식
[Br:11][CH2:12][c:13]1[cH:14][c:15]([C:16](=[O:17])[O:18][CH3:19])[cH:20][cH:21][cH:22]1.[CH2:23]([c:24]1[cH:25][cH:26][cH:27][cH:28][cH:29]1)[NH:30][C:31](=[O:32])[c:33]1[c:34]([CH3:44])[n:35][c:36]([N:38]2[C:39](=[O:43])[NH:40][CH2:41][CH2:42]2)[s:37]1.[Cl:1][CH2:2][c:3]1[cH:4][cH:5][c:6]([C:7]#[N:8])[cH:9][cH:10]1>>[CH2:12]([c:13]1[cH:14][c:15]([C:16](=[O:17])[O:18][CH3:19])[cH:20][cH:21][cH:22]1)[N:40]1[C:39](=[O:43])[N:38]([c:36]2[n:35][c:34]([CH3:44])[c:33]([C:31]([NH:30][CH2:23][c:24]3[cH:25][cH:26][cH:27][cH:28][cH:29]3)=[O:32])[s:37]2)[CH2:42][CH2:41]1참가 물질
4
출처 및 근거
- ORD 기록
- ord-351234488a3747fdb95ee80f63c7afa6
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
연결된 노트
불러오는 중…