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SMILES: n1(c(nnc1S)C(Oc1ccc(cc1)C)C)CC Canonical SMILES: CCn1c(S)nnc1C(Oc1ccc(cc1)C)C InChI: InChI=1S/C13H17N3OS/c1-4-16-12(14-15-13(16)18)10(3)17-11-7-5-9(2)6-8-11/h5-8,10H,4H2,1-3H3,(H,15,18) InChIKey: WJFCVAJLHFUAKR-UHFFFAOYSA-N
CBID:28020 http://www.chembase.cn/molecule-28020.html