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SMILES: n1(c(nnc1O)S)CCCC Canonical SMILES: CCCCn1c(O)nnc1S InChI: InChI=1S/C6H11N3OS/c1-2-3-4-9-5(10)7-8-6(9)11/h2-4H2,1H3,(H,7,10)(H,8,11) InChIKey: KGAKWIYWXDCKRE-UHFFFAOYSA-N
CBID:240852 http://www.chembase.cn/molecule-240852.html