6-azanyl-2-butoxy-9-[(6-piperidin-1-ylpyridin-3-yl)methyl]-7H-purin-8-one

Systemtic Name: 6-azanyl-2-butoxy-9-[(6-piperidin-1-ylpyridin-3-yl)methyl]-7H-purin-8-one Openeye Name: 6-amino-2-butoxy-9-[[6-(1-piperidyl)-3-pyridyl]methyl]-7H-purin-8-one CAS Name: 6-amino-2-butoxy-9-[[6-(1-piperidinyl)-3-pyridinyl]methyl]-7H-purin-8-one IUPAC Name: 6-amino-2-butoxy-9-[(6-piperidin-1-ylpyridin-3-yl)methyl]-7H-purin-8-one Traditional Name: 6-amino-2-butoxy-9-[(6-piperidino-3-pyridyl)methyl]-7H-purin-8-one Formula: C20H27N7O2 MolecularWeight: 397.47408

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=NC2=C(C(=N1)N)NC(=O)N2CC3=CN=C(C=C3)N4CCCCC4

Isomeric SMILES

CCCCOC1=NC2=C(C(=N1)N)NC(=O)N2CC3=CN=C(C=C3)N4CCCCC4

InChI

InChI=1S/C20H27N7O2/c1-2-3-11-29-19-24-17(21)16-18(25-19)27(20(28)23-16)13-14-7-8-15(22-12-14)26-9-5-4-6-10-26/h7-8,12H,2-6,9-11,13H2,1H3,(H,23,28)(H2,21,24,25)