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SMILES: c12c(nc(s1)N)c(cc(c2C)Br)C Canonical SMILES: Nc1sc2c(n1)c(C)cc(c2C)Br InChI: InChI=1S/C9H9BrN2S/c1-4-3-6(10)5(2)8-7(4)12-9(11)13-8/h3H,1-2H3,(H2,11,12) InChIKey: VPBSALFSVUNNPH-UHFFFAOYSA-N
CBID:308571 http://www.chembase.cn/molecule-308571.html