Methyl triflate → ethyl 1-methyl-2-(2-methylphenyl)-3-oxo-2,3-dihydro-1H-pyrazole-4-carboxylate
반응식
[CH3:1][c:2]1[c:3](-[n:8]2[nH:9][cH:10][c:11]([C:14](=[O:15])[O:16][CH2:17][CH3:18])[c:12]2=[O:13])[cH:4][cH:5][cH:6][cH:7]1.[F:19][C:20]([F:21])([F:22])[S:23]([O:24][CH3:25])(=[O:26])=[O:27]>>[CH3:1][c:2]1[c:3](-[n:8]2[n:9]([CH3:20])[cH:10][c:11]([C:14](=[O:15])[O:16][CH2:17][CH3:18])[c:12]2=[O:13])[cH:4][cH:5][cH:6][cH:7]1참가 물질
3
출처 및 근거
- ORD 기록
- ord-2e0048bff62940b4ba39dfd2250f2fe8
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
반응 노트
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