Acetate → 4-Acetamido-2-bromo-thiazole
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[BrH:1].[CH3:16][C:17]([O-:18])=[O:19].[CH3:20][C:21]([O:22][C:23](=[O:24])[CH3:25])=[O:26].[NH2:2][c:3]1[n:4][c:5]([Br:8])[s:6][cH:7]1.[Na+:15].[cH:9]1[cH:10][cH:11][n:12][cH:13][cH:14]1>>[NH:2]([c:3]1[n:4][c:5]([Br:8])[s:6][cH:7]1)[C:17]([CH3:16])=[O:18]참가 물질
7
출처 및 근거
- ORD 기록
- ord-bb0fbaf5a3e448099021e59d6100c517
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
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