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

Systemtic Name: 2-[(2,4-dimethylphenyl)methylsulfanyl]-5-[[4-(2-methylpropoxy)phenyl]methyl]-4-oxidanyl-1H-pyrimidin-6-one Openeye Name: 2-[(2,4-dimethylphenyl)methylsulfanyl]-4-hydroxy-5-[(4-isobutoxyphenyl)methyl]-1H-pyrimidin-6-one CAS Name: 2-[(2,4-dimethylphenyl)methylthio]-4-hydroxy-5-[[4-(2-methylpropoxy)phenyl]methyl]-1H-pyrimidin-6-one IUPAC Name: 2-[(2,4-dimethylphenyl)methylsulfanyl]-4-hydroxy-5-[[4-(2-methylpropoxy)phenyl]methyl]-1H-pyrimidin-6-one Traditional Name: 2-[(2,4-dimethylbenzyl)thio]-4-hydroxy-5-(4-isobutoxybenzyl)-1H-pyrimidin-6-one Formula: C24H28N2O3S MolecularWeight: 424.55572

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)CSC2=NC(=C(C(=O)N2)CC3=CC=C(C=C3)OCC(C)C)O)C

Isomeric SMILES

CC1=CC(=C(C=C1)CSC2=NC(=C(C(=O)N2)CC3=CC=C(C=C3)OCC(C)C)O)C

InChI

InChI=1S/C24H28N2O3S/c1-15(2)13-29-20-9-6-18(7-10-20)12-21-22(27)25-24(26-23(21)28)30-14-19-8-5-16(3)11-17(19)4/h5-11,15H,12-14H2,1-4H3,(H2,25,26,27,28)