2-(3-aminophenyl)-7-[(3-fluorophenyl)methyl]-3H-purin-6-one

Systemtic Name: 2-(3-aminophenyl)-7-[(3-fluorophenyl)methyl]-3H-purin-6-one Openeye Name: 2-(3-aminophenyl)-7-[(3-fluorophenyl)methyl]-3H-purin-6-one CAS Name: 2-(3-aminophenyl)-7-[(3-fluorophenyl)methyl]-3H-purin-6-one IUPAC Name: 2-(3-aminophenyl)-7-[(3-fluorophenyl)methyl]-3H-purin-6-one Traditional Name: 2-(3-aminophenyl)-7-(3-fluorobenzyl)-3H-purin-6-one Formula: C18H14FN5O MolecularWeight: 335.335063

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H14FN5O/c19-13-5-1-3-11(7-13)9-24-10-21-17-15(24)18(25)23-16(22-17)12-4-2-6-14(20)8-12/h1-8,10H,9,20H2,(H,22,23,25)