6-[(4-methoxyphenyl)methyl]-1-(1-oxidanyl-6-phenyl-hexan-3-yl)-2H-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 6-[(4-methoxyphenyl)methyl]-1-(1-oxidanyl-6-phenyl-hexan-3-yl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 1-[1-(2-hydroxyethyl)-4-phenyl-butyl]-6-[(4-methoxyphenyl)methyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 1-(1-hydroxy-6-phenylhexan-3-yl)-6-[(4-methoxyphenyl)methyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 1-(1-hydroxy-6-phenylhexan-3-yl)-6-[(4-methoxyphenyl)methyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 1-[1-(2-hydroxyethyl)-4-phenyl-butyl]-6-p-anisyl-2H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C25H28N4O3 MolecularWeight: 432.51482

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC2=NC(=O)C3=CNN(C3=N2)C(CCCC4=CC=CC=C4)CCO

Isomeric SMILES

COC1=CC=C(C=C1)CC2=NC(=O)C3=CNN(C3=N2)C(CCCC4=CC=CC=C4)CCO

InChI

InChI=1S/C25H28N4O3/c1-32-21-12-10-19(11-13-21)16-23-27-24-22(25(31)28-23)17-26-29(24)20(14-15-30)9-5-8-18-6-3-2-4-7-18/h2-4,6-7,10-13,17,20,26,30H,5,8-9,14-16H2,1H3