2-[(4-fluorophenyl)methyl]-9-(5-phenylpentan-2-yl)-3H-purin-6-one

Systemtic Name: 2-[(4-fluorophenyl)methyl]-9-(5-phenylpentan-2-yl)-3H-purin-6-one Openeye Name: 2-[(4-fluorophenyl)methyl]-9-(1-methyl-4-phenyl-butyl)-3H-purin-6-one CAS Name: 2-[(4-fluorophenyl)methyl]-9-(5-phenylpentan-2-yl)-3H-purin-6-one IUPAC Name: 2-[(4-fluorophenyl)methyl]-9-(5-phenylpentan-2-yl)-3H-purin-6-one Traditional Name: 2-(4-fluorobenzyl)-9-(1-methyl-4-phenyl-butyl)-3H-purin-6-one Formula: C23H23FN4O MolecularWeight: 390.453323

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCC1=CC=CC=C1)N2C=NC3=C2NC(=NC3=O)CC4=CC=C(C=C4)F

Isomeric SMILES

CC(CCCC1=CC=CC=C1)N2C=NC3=C2NC(=NC3=O)CC4=CC=C(C=C4)F

InChI

InChI=1S/C23H23FN4O/c1-16(6-5-9-17-7-3-2-4-8-17)28-15-25-21-22(28)26-20(27-23(21)29)14-18-10-12-19(24)13-11-18/h2-4,7-8,10-13,15-16H,5-6,9,14H2,1H3,(H,26,27,29)