Acetonitrile → 1-Isopropyl-8-(phenylsulfonyl)-3,8-dihydro-4H-[1,4]oxazepino[6,7-e]indole
반응식
[CH3:1][CH:2]([C:3](=[O:4])[NH:5][CH2:6][CH2:7][O:8][c:9]1[cH:10][c:11]2[cH:12][cH:13][n:14]([S:18](=[O:19])(=[O:20])[c:21]3[cH:22][cH:23][cH:24][cH:25][cH:26]3)[c:15]2[cH:16][cH:17]1)[CH3:27].[CH3:33][C:34]#[N:35].[P:28]([Cl:29])([Cl:30])([Cl:31])=[O:32]>>[CH3:1][CH:2]([C:3]1=[N:5][CH2:6][CH2:7][O:8][c:9]2[c:10]1[c:11]1[cH:12][cH:13][n:14]([S:18](=[O:19])(=[O:20])[c:21]3[cH:22][cH:23][cH:24][cH:25][cH:26]3)[c:15]1[cH:16][cH:17]2)[CH3:27]참가 물질
4
출처 및 근거
- ORD 기록
- ord-1ee9dff65c26447f8e32b8fa0f2fc9b6
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
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