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

Systemtic Name: 2-[(2,4-dimethylphenyl)methylsulfanyl]-6-methyl-5-[4-(2-methylpropoxy)phenyl]-1H-pyrimidin-4-one Openeye Name: 2-[(2,4-dimethylphenyl)methylsulfanyl]-5-(4-isobutoxyphenyl)-6-methyl-1H-pyrimidin-4-one CAS Name: 2-[(2,4-dimethylphenyl)methylthio]-6-methyl-5-[4-(2-methylpropoxy)phenyl]-1H-pyrimidin-4-one IUPAC Name: 2-[(2,4-dimethylphenyl)methylsulfanyl]-6-methyl-5-[4-(2-methylpropoxy)phenyl]-1H-pyrimidin-4-one Traditional Name: 2-[(2,4-dimethylbenzyl)thio]-5-(4-isobutoxyphenyl)-6-methyl-1H-pyrimidin-4-one Formula: C24H28N2O2S MolecularWeight: 408.55632

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H28N2O2S/c1-15(2)13-28-21-10-8-19(9-11-21)22-18(5)25-24(26-23(22)27)29-14-20-7-6-16(3)12-17(20)4/h6-12,15H,13-14H2,1-5H3,(H,25,26,27)