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

Systemtic Name: 6-[(3,4-dimethoxyphenyl)methyl]-1-(2-methyl-1-oxidanyl-6-phenyl-hexan-3-yl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 6-[(3,4-dimethoxyphenyl)methyl]-1-[1-(2-hydroxy-1-methyl-ethyl)-4-phenyl-butyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 6-[(3,4-dimethoxyphenyl)methyl]-1-(1-hydroxy-2-methyl-6-phenylhexan-3-yl)-2H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 6-[(3,4-dimethoxyphenyl)methyl]-1-(1-hydroxy-2-methyl-6-phenylhexan-3-yl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 1-[1-(2-hydroxy-1-methyl-ethyl)-4-phenyl-butyl]-6-veratryl-2H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C27H32N4O4 MolecularWeight: 476.56738

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Descriptors Computed from Structure

Canonical SMILES:

CC(CO)C(CCCC1=CC=CC=C1)N2C3=NC(=NC(=O)C3=CN2)CC4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CC(CO)C(CCCC1=CC=CC=C1)N2C3=NC(=NC(=O)C3=CN2)CC4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C27H32N4O4/c1-18(17-32)22(11-7-10-19-8-5-4-6-9-19)31-26-21(16-28-31)27(33)30-25(29-26)15-20-12-13-23(34-2)24(14-20)35-3/h4-6,8-9,12-14,16,18,22,28,32H,7,10-11,15,17H2,1-3H3