2-[(2,4-dimethylphenyl)methylsulfanyl]-5-(5-ethanoyl-2-methoxy-phenyl)-4-oxidanyl-1H-pyrimidin-6-one

Systemtic Name: 2-[(2,4-dimethylphenyl)methylsulfanyl]-5-(5-ethanoyl-2-methoxy-phenyl)-4-oxidanyl-1H-pyrimidin-6-one Openeye Name: 5-(5-acetyl-2-methoxy-phenyl)-2-[(2,4-dimethylphenyl)methylsulfanyl]-4-hydroxy-1H-pyrimidin-6-one CAS Name: 5-(5-acetyl-2-methoxyphenyl)-2-[(2,4-dimethylphenyl)methylthio]-4-hydroxy-1H-pyrimidin-6-one IUPAC Name: 5-(5-acetyl-2-methoxyphenyl)-2-[(2,4-dimethylphenyl)methylsulfanyl]-4-hydroxy-1H-pyrimidin-6-one Traditional Name: 5-(5-acetyl-2-methoxy-phenyl)-2-[(2,4-dimethylbenzyl)thio]-4-hydroxy-1H-pyrimidin-6-one Formula: C22H22N2O4S MolecularWeight: 410.48608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)CSC2=NC(=C(C(=O)N2)C3=C(C=CC(=C3)C(=O)C)OC)O)C

Isomeric SMILES

CC1=CC(=C(C=C1)CSC2=NC(=C(C(=O)N2)C3=C(C=CC(=C3)C(=O)C)OC)O)C

InChI

InChI=1S/C22H22N2O4S/c1-12-5-6-16(13(2)9-12)11-29-22-23-20(26)19(21(27)24-22)17-10-15(14(3)25)7-8-18(17)28-4/h5-10H,11H2,1-4H3,(H2,23,24,26,27)