3,6-dimethyl-5-[(3-methylphenyl)methyl]-2-[(3-methylphenyl)methylsulfanyl]pyrimidin-4-one

Systemtic Name: 3,6-dimethyl-5-[(3-methylphenyl)methyl]-2-[(3-methylphenyl)methylsulfanyl]pyrimidin-4-one Openeye Name: 3,6-dimethyl-5-(m-tolylmethyl)-2-(m-tolylmethylsulfanyl)pyrimidin-4-one CAS Name: 3,6-dimethyl-5-[(3-methylphenyl)methyl]-2-[(3-methylphenyl)methylthio]-4-pyrimidinone IUPAC Name: 3,6-dimethyl-5-[(3-methylphenyl)methyl]-2-[(3-methylphenyl)methylsulfanyl]pyrimidin-4-one Traditional Name: 3,6-dimethyl-5-(3-methylbenzyl)-2-[(3-methylbenzyl)thio]pyrimidin-4-one Formula: C22H24N2OS MolecularWeight: 364.50376

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CC2=C(N=C(N(C2=O)C)SCC3=CC=CC(=C3)C)C

Isomeric SMILES

CC1=CC(=CC=C1)CC2=C(N=C(N(C2=O)C)SCC3=CC=CC(=C3)C)C

InChI

InChI=1S/C22H24N2OS/c1-15-7-5-9-18(11-15)13-20-17(3)23-22(24(4)21(20)25)26-14-19-10-6-8-16(2)12-19/h5-12H,13-14H2,1-4H3