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

Systemtic Name: 1-cyclopropyl-7-[(2-fluorophenyl)methyl]-3-naphthalen-1-yl-purine-2,6-dione Openeye Name: 1-cyclopropyl-7-[(2-fluorophenyl)methyl]-3-(1-naphthyl)purine-2,6-dione CAS Name: 1-cyclopropyl-7-[(2-fluorophenyl)methyl]-3-(1-naphthalenyl)purine-2,6-dione IUPAC Name: 1-cyclopropyl-7-[(2-fluorophenyl)methyl]-3-naphthalen-1-ylpurine-2,6-dione Traditional Name: 1-cyclopropyl-7-(2-fluorobenzyl)-3-(1-naphthyl)xanthine Formula: C25H19FN4O2 MolecularWeight: 426.442363

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=O)C3=C(N=CN3CC4=CC=CC=C4F)N(C2=O)C5=CC=CC6=CC=CC=C65

Isomeric SMILES

C1CC1N2C(=O)C3=C(N=CN3CC4=CC=CC=C4F)N(C2=O)C5=CC=CC6=CC=CC=C65

InChI

InChI=1S/C25H19FN4O2/c26-20-10-4-2-7-17(20)14-28-15-27-23-22(28)24(31)29(18-12-13-18)25(32)30(23)21-11-5-8-16-6-1-3-9-19(16)21/h1-11,15,18H,12-14H2