7-(1,7-diazabicyclo[3.2.0]heptan-6-ylmethyl)-1,3-dimethyl-8-piperidin-1-yl-purine-2,6-dione

Systemtic Name: 7-(1,7-diazabicyclo[3.2.0]heptan-6-ylmethyl)-1,3-dimethyl-8-piperidin-1-yl-purine-2,6-dione Openeye Name: 7-(1,7-diazabicyclo[3.2.0]heptan-6-ylmethyl)-1,3-dimethyl-8-(1-piperidyl)purine-2,6-dione CAS Name: 7-(1,7-diazabicyclo[3.2.0]heptan-6-ylmethyl)-1,3-dimethyl-8-(1-piperidinyl)purine-2,6-dione IUPAC Name: 7-(1,7-diazabicyclo[3.2.0]heptan-6-ylmethyl)-1,3-dimethyl-8-piperidin-1-ylpurine-2,6-dione Traditional Name: 7-(1,7-diazabicyclo[3.2.0]heptan-6-ylmethyl)-1,3-dimethyl-8-piperidino-xanthine Formula: C18H27N7O2 MolecularWeight: 373.45268

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)N3CCCCC3)CC4C5CCCN5N4

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)N3CCCCC3)CC4C5CCCN5N4

InChI

InChI=1S/C18H27N7O2/c1-21-15-14(16(26)22(2)18(21)27)24(11-12-13-7-6-10-25(13)20-12)17(19-15)23-8-4-3-5-9-23/h12-13,20H,3-11H2,1-2H3