2-[(2-chlorophenyl)methylsulfanyl]-3-[(4-methylphenyl)methyl]-6-phenyl-pyrimidin-4-one

Systemtic Name: 2-[(2-chlorophenyl)methylsulfanyl]-3-[(4-methylphenyl)methyl]-6-phenyl-pyrimidin-4-one Openeye Name: 2-[(2-chlorophenyl)methylsulfanyl]-6-phenyl-3-(p-tolylmethyl)pyrimidin-4-one CAS Name: 2-[(2-chlorophenyl)methylthio]-3-[(4-methylphenyl)methyl]-6-phenyl-4-pyrimidinone IUPAC Name: 2-[(2-chlorophenyl)methylsulfanyl]-3-[(4-methylphenyl)methyl]-6-phenylpyrimidin-4-one Traditional Name: 2-[(2-chlorobenzyl)thio]-3-(4-methylbenzyl)-6-phenyl-pyrimidin-4-one Formula: C25H21ClN2OS MolecularWeight: 432.96504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(=O)C=C(N=C2SCC3=CC=CC=C3Cl)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(=O)C=C(N=C2SCC3=CC=CC=C3Cl)C4=CC=CC=C4

InChI

InChI=1S/C25H21ClN2OS/c1-18-11-13-19(14-12-18)16-28-24(29)15-23(20-7-3-2-4-8-20)27-25(28)30-17-21-9-5-6-10-22(21)26/h2-15H,16-17H2,1H3