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SMILES: n1(nc(nc1CCN1C(=O)CCC1)c1ccc(C(=O)N)cc1)c1ncccc1 Canonical SMILES: O=C1CCCN1CCc1nc(nn1c1ccccn1)c1ccc(cc1)C(=O)N InChI: InChI=1S/C20H20N6O2/c21-19(28)14-6-8-15(9-7-14)20-23-17(10-13-25-12-3-5-18(25)27)26(24-20)16-4-1-2-11-22-16/h1-2,4,6-9,11H,3,5,10,12-13H2,(H2,21,28) InChIKey: PCVRVGDLWJOENN-UHFFFAOYSA-N
CBID:460311 http://www.chembase.cn/molecule-460311.html