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

Systemtic Name: 2-(3-chlorophenyl)-7-[(2-fluorophenyl)methyl]-3H-purin-6-one Openeye Name: 2-(3-chlorophenyl)-7-[(2-fluorophenyl)methyl]-3H-purin-6-one CAS Name: 2-(3-chlorophenyl)-7-[(2-fluorophenyl)methyl]-3H-purin-6-one IUPAC Name: 2-(3-chlorophenyl)-7-[(2-fluorophenyl)methyl]-3H-purin-6-one Traditional Name: 2-(3-chlorophenyl)-7-(2-fluorobenzyl)-3H-purin-6-one Formula: C18H12ClFN4O MolecularWeight: 354.765483

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(=CC=C4)Cl)F

Isomeric SMILES

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

InChI

InChI=1S/C18H12ClFN4O/c19-13-6-3-5-11(8-13)16-22-17-15(18(25)23-16)24(10-21-17)9-12-4-1-2-7-14(12)20/h1-8,10H,9H2,(H,22,23,25)