Dimethyl Sulfoxide → 8-Methyl-2-[(4-naphthalen-2-ylpiperazin-1-yl)methyl]-2,3-dihydro-[1,4]dioxino[2,3-f]quinoline
반응식
[Br:1][c:2]1[cH:3][cH:4][c:5]([S:6]([O:7][CH2:12][CH:13]2[CH2:14][O:15][c:16]3[c:17]([c:18]4[cH:19][cH:20][c:21]([CH3:26])[n:22][c:23]4[cH:24][cH:25]3)[O:27]2)(=[O:8])=[O:9])[cH:10][cH:11]1.[C:48](=[O:49])([OH:50])[O-:51].[CH3:44][S:45]([CH3:46])=[O:47].[Na+:52].[cH:28]1[c:29]([N:38]2[CH2:39][CH2:40][NH:41][CH2:42][CH2:43]2)[cH:30][cH:31][c:32]2[cH:33][cH:34][cH:35][cH:36][c:37]12>>[CH2:12]([CH:13]1[CH2:14][O:15][c:16]2[c:17]([c:18]3[cH:19][cH:20][c:21]([CH3:26])[n:22][c:23]3[cH:24][cH:25]2)[O:27]1)[N:41]1[CH2:40][CH2:39][N:38]([c:29]2[cH:28][c:37]3[c:32]([cH:31][cH:30]2)[cH:33][cH:34][cH:35][cH:36]3)[CH2:43][CH2:42]1참가 물질
6
반응물 5
생성물 1
출처 및 근거
- ORD 기록
- ord-847d47ebdfa6444192103f81b71a6152
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
반응 노트
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