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

Systemtic Name: 7-[(3-chlorophenyl)methyl]-2-phenyl-3H-purin-6-one Openeye Name: 7-[(3-chlorophenyl)methyl]-2-phenyl-3H-purin-6-one CAS Name: 7-[(3-chlorophenyl)methyl]-2-phenyl-3H-purin-6-one IUPAC Name: 7-[(3-chlorophenyl)methyl]-2-phenyl-3H-purin-6-one Traditional Name: 7-(3-chlorobenzyl)-2-phenyl-3H-purin-6-one Formula: C18H13ClN4O MolecularWeight: 336.77502

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=O)C3=C(N2)N=CN3CC4=CC(=CC=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=O)C3=C(N2)N=CN3CC4=CC(=CC=C4)Cl

InChI

InChI=1S/C18H13ClN4O/c19-14-8-4-5-12(9-14)10-23-11-20-17-15(23)18(24)22-16(21-17)13-6-2-1-3-7-13/h1-9,11H,10H2,(H,21,22,24)