7-[(2-fluorophenyl)methyl]-2-pyridin-4-yl-3H-purin-6-one

Systemtic Name: 7-[(2-fluorophenyl)methyl]-2-pyridin-4-yl-3H-purin-6-one Openeye Name: 7-[(2-fluorophenyl)methyl]-2-(4-pyridyl)-3H-purin-6-one CAS Name: 7-[(2-fluorophenyl)methyl]-2-pyridin-4-yl-3H-purin-6-one IUPAC Name: 7-[(2-fluorophenyl)methyl]-2-pyridin-4-yl-3H-purin-6-one Traditional Name: 7-(2-fluorobenzyl)-2-(4-pyridyl)-3H-purin-6-one Formula: C17H12FN5O MolecularWeight: 321.308483

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CN2C=NC3=C2C(=O)N=C(N3)C4=CC=NC=C4)F

Isomeric SMILES

C1=CC=C(C(=C1)CN2C=NC3=C2C(=O)N=C(N3)C4=CC=NC=C4)F

InChI

InChI=1S/C17H12FN5O/c18-13-4-2-1-3-12(13)9-23-10-20-16-14(23)17(24)22-15(21-16)11-5-7-19-8-6-11/h1-8,10H,9H2,(H,21,22,24)