Methanol → 1-(4-Fluorophenyl)-3-(methoxyacetyl)-5-[4-(methylsulfonyl)phenyl]pyrazole
반응식
[C:1]([CH3:2])(=[O:3])[c:4]1[n:5][n:6](-[c:19]2[cH:20][cH:21][c:22]([F:25])[cH:23][cH:24]2)[c:7](-[c:9]2[cH:10][cH:11][c:12]([S:15](=[O:16])(=[O:17])[CH3:18])[cH:13][cH:14]2)[cH:8]1.[CH3:47][OH:48].[Cl+3:42]([OH:43])([O-:44])([O-:45])[O-:46].[N+:29]([O-:30])([O-:31])=[O:32].[N+:34]([O-:35])([O-:36])=[O:37].[N+:38]([O-:39])([O-:40])=[O:41].[O:49]1[CH2:50][CH2:51][O:52][CH2:53][CH2:54]1.[OH2:26].[OH2:27].[OH2:28].[Tl+3:33]>>[C:1]([CH2:2][O:26][CH3:47])(=[O:3])[c:4]1[n:5][n:6](-[c:19]2[cH:20][cH:21][c:22]([F:25])[cH:23][cH:24]2)[c:7](-[c:9]2[cH:10][cH:11][c:12]([S:15](=[O:16])(=[O:17])[CH3:18])[cH:13][cH:14]2)[cH:8]1참가 물질
8
출처 및 근거
- ORD 기록
- ord-48b9e59201d3482aaf9732cc91f86ec1
- 출처 데이터셋
- Test data from https://doi.org/10.1039/C8SC04228D
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