1-ethyl-7-[(3-fluorophenyl)methyl]-3-naphthalen-1-yl-purine-2,6-dione

Systemtic Name: 1-ethyl-7-[(3-fluorophenyl)methyl]-3-naphthalen-1-yl-purine-2,6-dione Openeye Name: 1-ethyl-7-[(3-fluorophenyl)methyl]-3-(1-naphthyl)purine-2,6-dione CAS Name: 1-ethyl-7-[(3-fluorophenyl)methyl]-3-(1-naphthalenyl)purine-2,6-dione IUPAC Name: 1-ethyl-7-[(3-fluorophenyl)methyl]-3-naphthalen-1-ylpurine-2,6-dione Traditional Name: 1-ethyl-7-(3-fluorobenzyl)-3-(1-naphthyl)xanthine Formula: C24H19FN4O2 MolecularWeight: 414.431663

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(N=CN2CC3=CC(=CC=C3)F)N(C1=O)C4=CC=CC5=CC=CC=C54

Isomeric SMILES

CCN1C(=O)C2=C(N=CN2CC3=CC(=CC=C3)F)N(C1=O)C4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C24H19FN4O2/c1-2-28-23(30)21-22(26-15-27(21)14-16-7-5-10-18(25)13-16)29(24(28)31)20-12-6-9-17-8-3-4-11-19(17)20/h3-13,15H,2,14H2,1H3