6-[(3,5-dimethylphenyl)methyl]-2-[(4-methoxyphenyl)methylsulfanyl]-5-methyl-1H-pyrimidin-4-one

Systemtic Name: 6-[(3,5-dimethylphenyl)methyl]-2-[(4-methoxyphenyl)methylsulfanyl]-5-methyl-1H-pyrimidin-4-one Openeye Name: 6-[(3,5-dimethylphenyl)methyl]-2-[(4-methoxyphenyl)methylsulfanyl]-5-methyl-1H-pyrimidin-4-one CAS Name: 6-[(3,5-dimethylphenyl)methyl]-2-[(4-methoxyphenyl)methylthio]-5-methyl-1H-pyrimidin-4-one IUPAC Name: 6-[(3,5-dimethylphenyl)methyl]-2-[(4-methoxyphenyl)methylsulfanyl]-5-methyl-1H-pyrimidin-4-one Traditional Name: 6-(3,5-dimethylbenzyl)-5-methyl-2-(p-anisylthio)-1H-pyrimidin-4-one Formula: C22H24N2O2S MolecularWeight: 380.50316

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)CC2=C(C(=O)N=C(N2)SCC3=CC=C(C=C3)OC)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)CC2=C(C(=O)N=C(N2)SCC3=CC=C(C=C3)OC)C)C

InChI

InChI=1S/C22H24N2O2S/c1-14-9-15(2)11-18(10-14)12-20-16(3)21(25)24-22(23-20)27-13-17-5-7-19(26-4)8-6-17/h5-11H,12-13H2,1-4H3,(H,23,24,25)