반응식
[CH2:40]([Cl:41])[Cl:42].[CH3:29][CH2:30][N:31]([CH2:32][CH3:33])[CH2:34][CH3:35].[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH:8]2[N:9]=[C:10]([c:20]3[c:21]([O:26][CH2:27][CH3:28])[n:22][cH:23][cH:24][cH:25]3)[NH:11][CH:12]2[c:13]2[cH:14][cH:15][c:16]([Cl:19])[cH:17][cH:18]2)[cH:6][cH:7]1.[Cl:36][C:37]([Cl:38])=[O:39]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH:8]2[N:9]=[C:10]([c:20]3[c:21]([O:26][CH2:27][CH3:28])[n:22][cH:23][cH:24][cH:25]3)[N:11]([C:37]([Cl:36])=[O:39])[CH:12]2[c:13]2[cH:14][cH:15][c:16]([Cl:19])[cH:17][cH:18]2)[cH:6][cH:7]1참가 물질
5
출처 및 근거
- ORD 기록
- ord-51361c5cdca24e769cb2880b16769efe
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
연결된 노트
불러오는 중…