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SMILES: s1c(nnc1N)C(Oc1ccc(cc1)CC)C Canonical SMILES: CCc1ccc(cc1)OC(c1nnc(s1)N)C InChI: InChI=1S/C12H15N3OS/c1-3-9-4-6-10(7-5-9)16-8(2)11-14-15-12(13)17-11/h4-8H,3H2,1-2H3,(H2,13,15) InChIKey: YNXINTUMCSZUOG-UHFFFAOYSA-N
CBID:307828 http://www.chembase.cn/molecule-307828.html