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

Systemtic Name: 5-[(2,5-dimethylphenyl)methyl]-2-[(2,4-dimethylphenyl)methylsulfanyl]-6-phenyl-1,3-diazinan-4-one Openeye Name: 5-[(2,5-dimethylphenyl)methyl]-2-[(2,4-dimethylphenyl)methylsulfanyl]-6-phenyl-hexahydropyrimidin-4-one CAS Name: 5-[(2,5-dimethylphenyl)methyl]-2-[(2,4-dimethylphenyl)methylthio]-6-phenyl-1,3-diazinan-4-one IUPAC Name: 5-[(2,5-dimethylphenyl)methyl]-2-[(2,4-dimethylphenyl)methylsulfanyl]-6-phenyl-1,3-diazinan-4-one Traditional Name: 5-(2,5-dimethylbenzyl)-2-[(2,4-dimethylbenzyl)thio]-6-phenyl-hexahydropyrimidin-4-one Formula: C28H32N2OS MolecularWeight: 444.63148

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)CSC2NC(C(C(=O)N2)CC3=C(C=CC(=C3)C)C)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=C(C=C1)CSC2NC(C(C(=O)N2)CC3=C(C=CC(=C3)C)C)C4=CC=CC=C4)C

InChI

InChI=1S/C28H32N2OS/c1-18-11-13-23(21(4)14-18)17-32-28-29-26(22-8-6-5-7-9-22)25(27(31)30-28)16-24-15-19(2)10-12-20(24)3/h5-15,25-26,28-29H,16-17H2,1-4H3,(H,30,31)