Ethanol → 1-N-[2-[[5-[(dimethylamino)methyl]thiophen-2-yl]methylsulfanyl]ethyl]-1-N'-(1-methoxyethyl)-2-nitroethene-1,1-diamine
반응식
[CH3:1][N:2]([CH3:3])[CH2:4][c:5]1[cH:6][cH:7][c:8]([CH2:10][S:11][CH2:12][CH2:13][NH2:14])[s:9]1.[CH3:24][O:25][CH:26]([CH3:27])[NH2:28].[CH3:29][CH2:30][OH:31].[N+:15](=[O:16])([O-:17])[CH:18]=[C:19]([S:20][CH3:21])[S:22][CH3:23]>>[CH3:1][N:2]([CH3:3])[CH2:4][c:5]1[cH:6][cH:7][c:8]([CH2:10][S:11][CH2:12][CH2:13][NH:14][C:19](=[CH:18][N+:15](=[O:16])[O-:17])[NH:28][CH:26]([O:25][CH3:24])[CH3:27])[s:9]1참가 물질
5
출처 및 근거
- ORD 기록
- ord-683a76c6e4204ab1bca94ada1c155fec
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
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