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SMILES: C(=O)(C)c1c(ncc(c1)Br)N Canonical SMILES: Brc1cnc(c(c1)C(=O)C)N InChI: InChI=1S/C7H7BrN2O/c1-4(11)6-2-5(8)3-10-7(6)9/h2-3H,1H3,(H2,9,10) InChIKey: SEKSQHBOPVONLC-UHFFFAOYSA-N
CBID:814234 http://www.chembase.cn/molecule-814234.html