6-(4-octoxyphenyl)-1-phenyl-5,6-dihydro-2H-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 6-(4-octoxyphenyl)-1-phenyl-5,6-dihydro-2H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 6-(4-octoxyphenyl)-1-phenyl-5,6-dihydro-2H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 6-(4-octoxyphenyl)-1-phenyl-5,6-dihydro-2H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 6-(4-octoxyphenyl)-1-phenyl-5,6-dihydro-2H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 6-(4-octoxyphenyl)-1-phenyl-5,6-dihydro-2H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C25H30N4O2 MolecularWeight: 418.5313

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C2NC(=O)C3=CNN(C3=N2)C4=CC=CC=C4

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C2NC(=O)C3=CNN(C3=N2)C4=CC=CC=C4

InChI

InChI=1S/C25H30N4O2/c1-2-3-4-5-6-10-17-31-21-15-13-19(14-16-21)23-27-24-22(25(30)28-23)18-26-29(24)20-11-8-7-9-12-20/h7-9,11-16,18,23,26H,2-6,10,17H2,1H3,(H,28,30)