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[CH3:32][CH2:33][O:34][C:35](=[O:36])[CH3:37].[Cl:21][c:22]1[cH:23][c:24]([N:29]=[C:30]=[S:31])[cH:25][c:26]([Cl:28])[cH:27]1.[NH2:1][c:2]1[cH:3][c:4]([C:5](=[O:6])[NH:7][c:8]2[cH:9][cH:10][c:11]([O:14][CH3:15])[cH:12][cH:13]2)[cH:16][cH:17][c:18]1[O:19][CH3:20]>>[NH:1]([c:2]1[cH:3][c:4]([C:5](=[O:6])[NH:7][c:8]2[cH:9][cH:10][c:11]([O:14][CH3:15])[cH:12][cH:13]2)[cH:16][cH:17][c:18]1[O:19][CH3:20])[C:30]([NH:29][c:24]1[cH:23][c:22]([Cl:21])[cH:27][c:26]([Cl:28])[cH:25]1)=[S:31]참가 물질
4
출처 및 근거
- ORD 기록
- ord-39cab442476042a68df125f9675ff2b3
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
연결된 노트
불러오는 중…