Ethanol → 3-Cyano-5-(1-isopropyl-6-oxo-1,6-dihydro-3-pyridazinyl)-6-phenyl-2-pyrazinecarboxamide
반응식
[CH3:27][CH2:28][OH:29].[CH:1]([CH3:2])([CH3:3])[n:4]1[n:5][c:6](-[c:11]2[n:12][c:13]([C:25]#[N:26])[c:14]([C:23]#[N:24])[n:15][c:16]2-[c:17]2[cH:18][cH:19][cH:20][cH:21][cH:22]2)[cH:7][cH:8][c:9]1=[O:10].[OH2:32].[OH:30][OH:31]>>[CH:1]([CH3:2])([CH3:3])[n:4]1[n:5][c:6](-[c:11]2[n:12][c:13]([C:25]#[N:26])[c:14]([C:23]([NH2:24])=[O:29])[n:15][c:16]2-[c:17]2[cH:18][cH:19][cH:20][cH:21][cH:22]2)[cH:7][cH:8][c:9]1=[O:10]참가 물질
5
출처 및 근거
- ORD 기록
- ord-34f3b71150244872ade1d3bb5d70411a
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
반응 노트
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