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SMILES: n12c(c(ncn1)N)c(cc2)Br Canonical SMILES: Brc1ccn2c1c(N)ncn2 InChI: InChI=1S/C6H5BrN4/c7-4-1-2-11-5(4)6(8)9-3-10-11/h1-3H,(H2,8,9,10) InChIKey: UKQXPHHOTNGTKE-UHFFFAOYSA-N
CBID:65880 http://www.chembase.cn/molecule-65880.html