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

Systemtic Name: 1-decan-4-yl-6-[(3,4-dimethoxyphenyl)methyl]-3-methyl-2H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 6-[(3,4-dimethoxyphenyl)methyl]-3-methyl-1-(1-propylheptyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 1-decan-4-yl-6-[(3,4-dimethoxyphenyl)methyl]-3-methyl-2H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 1-decan-4-yl-6-[(3,4-dimethoxyphenyl)methyl]-3-methyl-2H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 3-methyl-1-(1-propylheptyl)-6-veratryl-2H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C25H36N4O3 MolecularWeight: 440.57834

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CCC)N1C2=NC(=NC(=O)C2=C(N1)C)CC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CCCCCCC(CCC)N1C2=NC(=NC(=O)C2=C(N1)C)CC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C25H36N4O3/c1-6-8-9-10-12-19(11-7-2)29-24-23(17(3)28-29)25(30)27-22(26-24)16-18-13-14-20(31-4)21(15-18)32-5/h13-15,19,28H,6-12,16H2,1-5H3