1-decan-4-yl-3-propyl-6-[(3,4,5-trimethoxyphenyl)methyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 1-decan-4-yl-3-propyl-6-[(3,4,5-trimethoxyphenyl)methyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 3-propyl-1-(1-propylheptyl)-6-[(3,4,5-trimethoxyphenyl)methyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 1-decan-4-yl-3-propyl-6-[(3,4,5-trimethoxyphenyl)methyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 1-decan-4-yl-3-propyl-6-[(3,4,5-trimethoxyphenyl)methyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 3-propyl-1-(1-propylheptyl)-6-(3,4,5-trimethoxybenzyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C28H42N4O4 MolecularWeight: 498.65748

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H42N4O4/c1-7-10-11-12-15-20(13-8-2)32-27-25(21(31-32)14-9-3)28(33)30-24(29-27)18-19-16-22(34-4)26(36-6)23(17-19)35-5/h16-17,20,31H,7-15,18H2,1-6H3