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SMILES: c1(nc([nH]n1)C)c1c(cc(cc1)Br)Cl Canonical SMILES: Brc1ccc(c(c1)Cl)c1n[nH]c(n1)C InChI: InChI=1S/C9H7BrClN3/c1-5-12-9(14-13-5)7-3-2-6(10)4-8(7)11/h2-4H,1H3,(H,12,13,14) InChIKey: WPYPETXIJOAIIL-UHFFFAOYSA-N
CBID:270125 http://www.chembase.cn/molecule-270125.html