2-cyclopentyl-9-(5-phenylpentan-2-yl)-3H-purin-6-one

Systemtic Name: 2-cyclopentyl-9-(5-phenylpentan-2-yl)-3H-purin-6-one Openeye Name: 2-cyclopentyl-9-(1-methyl-4-phenyl-butyl)-3H-purin-6-one CAS Name: 2-cyclopentyl-9-(5-phenylpentan-2-yl)-3H-purin-6-one IUPAC Name: 2-cyclopentyl-9-(5-phenylpentan-2-yl)-3H-purin-6-one Traditional Name: 2-cyclopentyl-9-(1-methyl-4-phenyl-butyl)-3H-purin-6-one Formula: C21H26N4O MolecularWeight: 350.45734

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCC1=CC=CC=C1)N2C=NC3=C2NC(=NC3=O)C4CCCC4

Isomeric SMILES

CC(CCCC1=CC=CC=C1)N2C=NC3=C2NC(=NC3=O)C4CCCC4

InChI

InChI=1S/C21H26N4O/c1-15(8-7-11-16-9-3-2-4-10-16)25-14-22-18-20(25)23-19(24-21(18)26)17-12-5-6-13-17/h2-4,9-10,14-15,17H,5-8,11-13H2,1H3,(H,23,24,26)