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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H12ClFN4O/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,9H2,(H,22,23,25)