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SMILES: c12c(N3CC(C(=O)NCCc4c[nH]c5c4cccc5)CCC3)ncnc1[nH]cn2 Canonical SMILES: O=C(C1CCCN(C1)c1ncnc2c1nc[nH]2)NCCc1c[nH]c2c1cccc2 InChI: InChI=1S/C21H23N7O/c29-21(22-8-7-14-10-23-17-6-2-1-5-16(14)17)15-4-3-9-28(11-15)20-18-19(25-12-24-18)26-13-27-20/h1-2,5-6,10,12-13,15,23H,3-4,7-9,11H2,(H,22,29)(H,24,25,26,27) InChIKey: MAAVNWXYVRBPEO-UHFFFAOYSA-N
CBID:217678 http://www.chembase.cn/molecule-217678.html