반응식
[CH2:11]1[CH2:12][CH2:13][C:14]2=[N:19][CH2:18][CH2:17][CH2:16][N:15]2[CH2:20][CH2:21]1.[CH2:28]1[O:29][CH2:30][CH2:31][CH2:32]1.[CH3:22][N:23]([C:24](=[S:25])[Cl:26])[CH3:27].[CH3:33][CH2:34][O:35][C:36]([CH3:37])=[O:38].[Cl:1][c:2]1[c:3]([OH:10])[cH:4][cH:5][c:6]([O:8][CH3:9])[cH:7]1>>[Cl:1][c:2]1[c:3]([O:10][C:24]([N:23]([CH3:22])[CH3:27])=[S:25])[cH:4][cH:5][c:6]([O:8][CH3:9])[cH:7]1참가 물질
6
출처 및 근거
- ORD 기록
- ord-b12c2272f2cb49fb85e9ef60d24c2b17
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
연결된 노트
불러오는 중…