Methyl 4-chloroformylbutyrate → 4-[5-(3-Fluoro-4-methanesulfonyl-phenyl)-4-methyl-thiazol-2-ylcarbamoyl]-butyric acid methyl ester
반응식
[CH3:1][O:2][C:3]([CH2:4][CH2:5][CH2:6][C:7](=[O:8])[Cl:9])=[O:10].[F:11][c:12]1[cH:13][c:14](-[c:22]2[c:23]([CH3:28])[n:24][c:25]([NH2:27])[s:26]2)[cH:15][cH:16][c:17]1[S:18](=[O:19])(=[O:20])[CH3:21]>>[CH3:1][O:2][C:3]([CH2:4][CH2:5][CH2:6][C:7](=[O:8])[NH:27][c:25]1[n:24][c:23]([CH3:28])[c:22](-[c:14]2[cH:13][c:12]([F:11])[c:17]([S:18](=[O:19])(=[O:20])[CH3:21])[cH:16][cH:15]2)[s:26]1)=[O:10]참가 물질
3
출처 및 근거
- ORD 기록
- ord-ae8bd4764ac64efda8e43b398b74d539
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
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