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SMILES: n1(ncc(c1)Br)CC(=O)NC Canonical SMILES: CNC(=O)Cn1cc(cn1)Br InChI: InChI=1S/C6H8BrN3O/c1-8-6(11)4-10-3-5(7)2-9-10/h2-3H,4H2,1H3,(H,8,11) InChIKey: TWHACBMAWLNUBF-UHFFFAOYSA-N
CBID:308933 http://www.chembase.cn/molecule-308933.html