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

Systemtic Name: 5-[(2,5-dimethylphenyl)methyl]-2-[(4-ethoxyphenyl)methylsulfanyl]-6-phenyl-1,3-diazinan-4-one Openeye Name: 5-[(2,5-dimethylphenyl)methyl]-2-[(4-ethoxyphenyl)methylsulfanyl]-6-phenyl-hexahydropyrimidin-4-one CAS Name: 5-[(2,5-dimethylphenyl)methyl]-2-[(4-ethoxyphenyl)methylthio]-6-phenyl-1,3-diazinan-4-one IUPAC Name: 5-[(2,5-dimethylphenyl)methyl]-2-[(4-ethoxyphenyl)methylsulfanyl]-6-phenyl-1,3-diazinan-4-one Traditional Name: 5-(2,5-dimethylbenzyl)-2-[(4-ethoxybenzyl)thio]-6-phenyl-hexahydropyrimidin-4-one Formula: C28H32N2O2S MolecularWeight: 460.63088

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CSC2NC(C(C(=O)N2)CC3=C(C=CC(=C3)C)C)C4=CC=CC=C4

Isomeric SMILES

CCOC1=CC=C(C=C1)CSC2NC(C(C(=O)N2)CC3=C(C=CC(=C3)C)C)C4=CC=CC=C4

InChI

InChI=1S/C28H32N2O2S/c1-4-32-24-14-12-21(13-15-24)18-33-28-29-26(22-8-6-5-7-9-22)25(27(31)30-28)17-23-16-19(2)10-11-20(23)3/h5-16,25-26,28-29H,4,17-18H2,1-3H3,(H,30,31)