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SMILES: C(c1c(Br)cccc1)(c1nnc(cc1)Cl)C#N Canonical SMILES: N#CC(c1ccccc1Br)c1ccc(nn1)Cl InChI: InChI=1S/C12H7BrClN3/c13-10-4-2-1-3-8(10)9(7-15)11-5-6-12(14)17-16-11/h1-6,9H InChIKey: ONAWCCQCISRDPI-UHFFFAOYSA-N
CBID:40980 http://www.chembase.cn/molecule-40980.html