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SMILES: c1(n(nnn1)CCOC)C1CN(c2c3c(sc(c3C)C)ncn2)CCO1 Canonical SMILES: COCCn1nnnc1C1OCCN(C1)c1ncnc2c1c(C)c(s2)C InChI: InChI=1S/C16H21N7O2S/c1-10-11(2)26-16-13(10)15(17-9-18-16)22-4-7-25-12(8-22)14-19-20-21-23(14)5-6-24-3/h9,12H,4-8H2,1-3H3 InChIKey: RCOVEGQUCAZKTL-UHFFFAOYSA-N
CBID:421341 http://www.chembase.cn/molecule-421341.html