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SMILES: s1c(nnc1COc1ccccc1)N Canonical SMILES: Nc1nnc(s1)COc1ccccc1 InChI: InChI=1S/C9H9N3OS/c10-9-12-11-8(14-9)6-13-7-4-2-1-3-5-7/h1-5H,6H2,(H2,10,12) InChIKey: CLQBSPRBHILXIC-UHFFFAOYSA-N
CBID:10856 http://www.chembase.cn/molecule-10856.html