4-Bromo-3-methylisoxazol-5-amine → HCID 23445238, 화합물
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[Cl:1][S:2](=[O:3])(=[O:4])[c:5]1[cH:6][cH:7][c:8](-[c:10]2[cH:11][cH:12][c:13]([O:16][CH3:17])[cH:14][cH:15]2)[s:9]1.[NH2:18][c:19]1[c:20]([Br:25])[c:21]([CH3:24])[n:22][o:23]1>>[S:2](=[O:3])(=[O:4])([c:5]1[cH:6][cH:7][c:8](-[c:10]2[cH:11][cH:12][c:13]([O:16][CH3:17])[cH:14][cH:15]2)[s:9]1)[NH:18][c:19]1[c:20]([Br:25])[c:21]([CH3:24])[n:22][o:23]1참가 물질
3
출처 및 근거
- ORD 기록
- ord-eb63bb0ba5c14072a1316d6792cbb460
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
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