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SMILES: n1(c(nnc1S)c1cc(Br)ccc1)N Canonical SMILES: Brc1cccc(c1)c1nnc(n1N)S InChI: InChI=1S/C8H7BrN4S/c9-6-3-1-2-5(4-6)7-11-12-8(14)13(7)10/h1-4H,10H2,(H,12,14) InChIKey: GVXBYQYIFQIOCT-UHFFFAOYSA-N
CBID:246965 http://www.chembase.cn/molecule-246965.html