2-(3,4-dimethoxyphenyl)-9-(5-phenylpentan-2-yl)-3H-purin-6-one

Systemtic Name: 2-(3,4-dimethoxyphenyl)-9-(5-phenylpentan-2-yl)-3H-purin-6-one Openeye Name: 2-(3,4-dimethoxyphenyl)-9-(1-methyl-4-phenyl-butyl)-3H-purin-6-one CAS Name: 2-(3,4-dimethoxyphenyl)-9-(5-phenylpentan-2-yl)-3H-purin-6-one IUPAC Name: 2-(3,4-dimethoxyphenyl)-9-(5-phenylpentan-2-yl)-3H-purin-6-one Traditional Name: 2-(3,4-dimethoxyphenyl)-9-(1-methyl-4-phenyl-butyl)-3H-purin-6-one Formula: C24H26N4O3 MolecularWeight: 418.48824

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCC1=CC=CC=C1)N2C=NC3=C2NC(=NC3=O)C4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CC(CCCC1=CC=CC=C1)N2C=NC3=C2NC(=NC3=O)C4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C24H26N4O3/c1-16(8-7-11-17-9-5-4-6-10-17)28-15-25-21-23(28)26-22(27-24(21)29)18-12-13-19(30-2)20(14-18)31-3/h4-6,9-10,12-16H,7-8,11H2,1-3H3,(H,26,27,29)