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SMILES: c12c(c(=O)[nH]c(=O)[nH]1)n(cn2)CCN(C)C.Cl.O Canonical SMILES: CN(CCn1cnc2c1c(=O)[nH]c(=O)[nH]2)C.O.Cl InChI: InChI=1S/C9H13N5O2.ClH.H2O/c1-13(2)3-4-14-5-10-7-6(14)8(15)12-9(16)11-7;;/h5H,3-4H2,1-2H3,(H2,11,12,15,16);1H;1H2 InChIKey: FECODSLRZPBNMM-UHFFFAOYSA-N
CBID:189175 http://www.chembase.cn/molecule-189175.html