Ethanol → 6-Ethylsulfanyl-5-fluoro-2-(4-methoxy-benzylamino)-nicotinic acid ethyl ester
반응식
[CH2:1]([CH3:2])[O:3][C:4]([c:5]1[c:6]([Cl:15])[n:7][c:8]([S:12][CH2:13][CH3:14])[c:9]([F:11])[cH:10]1)=[O:16].[CH3:17][O:18][c:19]1[cH:20][cH:21][c:22]([CH2:23][NH2:24])[cH:25][cH:26]1.[CH3:27][CH2:28][OH:29]>>[CH2:1]([CH3:2])[O:3][C:4]([c:5]1[c:6]([NH:24][CH2:23][c:22]2[cH:21][cH:20][c:19]([O:18][CH3:17])[cH:26][cH:25]2)[n:7][c:8]([S:12][CH2:13][CH3:14])[c:9]([F:11])[cH:10]1)=[O:16]참가 물질
4
출처 및 근거
- ORD 기록
- ord-d9b012f095204f8aaf959711362f5d24
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
반응 노트
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