Acetonitrile → 1-{2-[2-(dimethylamino)ethyl]-1,3-dioxo-2,3-dihydro-1H-dibenzo[de,h]isoquinolin-11-yl}-3-[4-trifluoromethylphenyl]thiourea
반응식
[CH3:39][C:40]#[N:41].[F:26][C:27]([c:28]1[cH:29][cH:30][c:31]([N:34]=[C:35]=[S:36])[cH:32][cH:33]1)([F:37])[F:38].[NH2:1][c:2]1[cH:3][cH:4][cH:5][c:6]2[cH:7][c:8]3[c:9]4[c:10]([cH:23][cH:24][cH:25]3)[C:11](=[O:22])[N:12]([CH2:17][CH2:18][N:19]([CH3:20])[CH3:21])[C:13](=[O:16])[c:14]4[c:15]12>>[NH:1]([c:2]1[cH:3][cH:4][cH:5][c:6]2[cH:7][c:8]3[c:9]4[c:10]([cH:23][cH:24][cH:25]3)[C:11](=[O:22])[N:12]([CH2:17][CH2:18][N:19]([CH3:20])[CH3:21])[C:13](=[O:16])[c:14]4[c:15]12)[C:35]([NH:34][c:31]1[cH:30][cH:29][c:28]([C:27]([F:26])([F:37])[F:38])[cH:33][cH:32]1)=[S:36]참가 물질
4
반응물 3
생성물 1
출처 및 근거
- ORD 기록
- ord-802cce28dd3b4f399c3c0bfcd5cf7578
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
반응 노트
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