2-[(2-chlorophenyl)methylsulfanyl]-3-(naphthalen-1-ylmethyl)-6-phenyl-pyrimidin-4-one

Systemtic Name: 2-[(2-chlorophenyl)methylsulfanyl]-3-(naphthalen-1-ylmethyl)-6-phenyl-pyrimidin-4-one Openeye Name: 2-[(2-chlorophenyl)methylsulfanyl]-3-(1-naphthylmethyl)-6-phenyl-pyrimidin-4-one CAS Name: 2-[(2-chlorophenyl)methylthio]-3-(1-naphthalenylmethyl)-6-phenyl-4-pyrimidinone IUPAC Name: 2-[(2-chlorophenyl)methylsulfanyl]-3-(naphthalen-1-ylmethyl)-6-phenylpyrimidin-4-one Traditional Name: 2-[(2-chlorobenzyl)thio]-3-(1-naphthylmethyl)-6-phenyl-pyrimidin-4-one Formula: C28H21ClN2OS MolecularWeight: 468.99714

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=O)N(C(=N2)SCC3=CC=CC=C3Cl)CC4=CC=CC5=CC=CC=C54

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=O)N(C(=N2)SCC3=CC=CC=C3Cl)CC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C28H21ClN2OS/c29-25-16-7-5-12-23(25)19-33-28-30-26(21-10-2-1-3-11-21)17-27(32)31(28)18-22-14-8-13-20-9-4-6-15-24(20)22/h1-17H,18-19H2