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[Br:1][c:2]1[n:3][cH:4][cH:5][c:6]([Br:8])[n:7]1.[C:16](=[O:17])([O-:18])[O-:19].[CH3:9][N:10]([S:11](=[O:12])(=[O:13])[NH2:14])[CH3:15].[Cs+:20].[Cs+:21].[O:24]=[C:25]([CH:26]=[CH:27][c:28]1[cH:29][cH:30][cH:31][cH:32][cH:33]1)[CH:34]=[CH:35][c:36]1[cH:37][cH:38][cH:39][cH:40][cH:41]1.[O:42]=[C:43]([CH:44]=[CH:45][c:46]1[cH:47][cH:48][cH:49][cH:50][cH:51]1)[CH:52]=[CH:53][c:54]1[cH:55][cH:56][cH:57][cH:58][cH:59]1.[O:60]=[C:61]([CH:62]=[CH:63][c:64]1[cH:65][cH:66][cH:67][cH:68][cH:69]1)[CH:70]=[CH:71][c:72]1[cH:73][cH:74][cH:75][cH:76][cH:77]1.[O:78]1[CH2:79][CH2:80][O:81][CH2:82][CH2:83]1.[Pd:22].[Pd:23]>>[c:2]1([NH:14][S:11]([N:10]([CH3:9])[CH3:15])(=[O:12])=[O:13])[n:3][cH:4][cH:5][c:6]([Br:8])[n:7]1참가 물질
8
출처 및 근거
- ORD 기록
- ord-360228db2ffb4e6f826019dc12829727
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
연결된 노트
불러오는 중…