Ethanol → Ethyl[1-(4-aminosulfonylphenyl)-5-(4-chlorophenyl)-1H-pyrazole-3-yl]carboxylate
반응식
[CH3:1][O:2][C:3](=[O:4])[c:5]1[n:6][n:7](-[c:17]2[cH:18][cH:19][c:20]([S:23](=[O:24])(=[O:25])[NH2:26])[cH:21][cH:22]2)[c:8](-[c:10]2[cH:11][cH:12][c:13]([Cl:16])[cH:14][cH:15]2)[cH:9]1.[CH3:27][CH2:28][O-:29].[CH3:31][CH2:32][OH:33].[CH3:35][CH2:36][OH:37].[Na+:30].[OH2:34]>>[CH2:1]([O:2][C:3](=[O:4])[c:5]1[n:6][n:7](-[c:17]2[cH:18][cH:19][c:20]([S:23](=[O:24])(=[O:25])[NH2:26])[cH:21][cH:22]2)[c:8](-[c:10]2[cH:11][cH:12][c:13]([Cl:16])[cH:14][cH:15]2)[cH:9]1)[CH3:27]참가 물질
6
출처 및 근거
- ORD 기록
- ord-2eadd9f7d45b4f499499d3243207f4a5
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
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