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SMILES: n1(c(nnc1S)C(Oc1ccc(cc1)C)C)C Canonical SMILES: Cc1ccc(cc1)OC(c1nnc(n1C)S)C InChI: InChI=1S/C12H15N3OS/c1-8-4-6-10(7-5-8)16-9(2)11-13-14-12(17)15(11)3/h4-7,9H,1-3H3,(H,14,17) InChIKey: IJHSPALLUGDQLM-UHFFFAOYSA-N
CBID:28019 http://www.chembase.cn/molecule-28019.html