5-[(2-chlorophenyl)methyl]-2-[(2,4-dimethylphenyl)methylsulfanyl]-6-phenyl-1,3-diazinan-4-one

Systemtic Name: 5-[(2-chlorophenyl)methyl]-2-[(2,4-dimethylphenyl)methylsulfanyl]-6-phenyl-1,3-diazinan-4-one Openeye Name: 5-[(2-chlorophenyl)methyl]-2-[(2,4-dimethylphenyl)methylsulfanyl]-6-phenyl-hexahydropyrimidin-4-one CAS Name: 5-[(2-chlorophenyl)methyl]-2-[(2,4-dimethylphenyl)methylthio]-6-phenyl-1,3-diazinan-4-one IUPAC Name: 5-[(2-chlorophenyl)methyl]-2-[(2,4-dimethylphenyl)methylsulfanyl]-6-phenyl-1,3-diazinan-4-one Traditional Name: 5-(2-chlorobenzyl)-2-[(2,4-dimethylbenzyl)thio]-6-phenyl-hexahydropyrimidin-4-one Formula: C26H27ClN2OS MolecularWeight: 451.02338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)CSC2NC(C(C(=O)N2)CC3=CC=CC=C3Cl)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=C(C=C1)CSC2NC(C(C(=O)N2)CC3=CC=CC=C3Cl)C4=CC=CC=C4)C

InChI

InChI=1S/C26H27ClN2OS/c1-17-12-13-21(18(2)14-17)16-31-26-28-24(19-8-4-3-5-9-19)22(25(30)29-26)15-20-10-6-7-11-23(20)27/h3-14,22,24,26,28H,15-16H2,1-2H3,(H,29,30)