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[CH3:1][O:2][C:3](=[O:4])[c:5]1[s:6][c:7](-[c:14]2[cH:15][cH:16][cH:17][cH:18][cH:19]2)[cH:8][c:9]1[NH:10][N:11]([CH3:12])[CH3:13].[Cl:22][c:23]1[c:24]([C:25](=[O:26])[Cl:27])[cH:28][cH:29][c:30]([Cl:32])[cH:31]1.[Cl:33][CH2:34][CH2:35][Cl:36].[N:20]#[N:21]>>[CH3:1][O:2][C:3](=[O:4])[c:5]1[s:6][c:7](-[c:14]2[cH:15][cH:16][cH:17][cH:18][cH:19]2)[cH:8][c:9]1[N:10]([N:11]([CH3:12])[CH3:13])[C:25]([c:24]1[c:23]([Cl:22])[cH:31][c:30]([Cl:32])[cH:29][cH:28]1)=[O:26]참가 물질
5
출처 및 근거
- ORD 기록
- ord-a5cf37ec549f46de8fb4e6c89d6a3ca8
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
연결된 노트
불러오는 중…