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[CH2:35]1[O:36][CH2:37][CH2:38][CH2:39]1.[CH3:28][N:29]([CH2:30][C:31](=[O:32])[Cl:33])[CH3:34].[NH2:1][c:2]1[cH:3][cH:4][c:5]([S:8][C:9]2=[CH:10][C:11](=[C:19]3[C:20]([CH2:25][CH2:26][CH3:27])=[N:21][NH:22][C:23]3=[O:24])[NH:12][c:13]3[cH:14][cH:15][cH:16][cH:17][c:18]32)[cH:6][cH:7]1>>[NH:1]([c:2]1[cH:3][cH:4][c:5]([S:8][C:9]2=[CH:10][C:11](=[C:19]3[C:20]([CH2:25][CH2:26][CH3:27])=[N:21][NH:22][C:23]3=[O:24])[NH:12][c:13]3[cH:14][cH:15][cH:16][cH:17][c:18]32)[cH:6][cH:7]1)[C:31]([CH2:30][N:29]([CH3:28])[CH3:34])=[O:32]참가 물질
4
출처 및 근거
- ORD 기록
- ord-b4f871b161704a87ae8c0fa56e1277b7
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
연결된 노트
불러오는 중…