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

Systemtic Name: 6-[(3,5-dimethylphenyl)methyl]-2-(3-methoxyphenyl)sulfanyl-5-methyl-1H-pyrimidin-4-one Openeye Name: 6-[(3,5-dimethylphenyl)methyl]-2-(3-methoxyphenyl)sulfanyl-5-methyl-1H-pyrimidin-4-one CAS Name: 6-[(3,5-dimethylphenyl)methyl]-2-[(3-methoxyphenyl)thio]-5-methyl-1H-pyrimidin-4-one IUPAC Name: 6-[(3,5-dimethylphenyl)methyl]-2-(3-methoxyphenyl)sulfanyl-5-methyl-1H-pyrimidin-4-one Traditional Name: 6-(3,5-dimethylbenzyl)-2-[(3-methoxyphenyl)thio]-5-methyl-1H-pyrimidin-4-one Formula: C21H22N2O2S MolecularWeight: 366.47658

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)CC2=C(C(=O)N=C(N2)SC3=CC=CC(=C3)OC)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)CC2=C(C(=O)N=C(N2)SC3=CC=CC(=C3)OC)C)C

InChI

InChI=1S/C21H22N2O2S/c1-13-8-14(2)10-16(9-13)11-19-15(3)20(24)23-21(22-19)26-18-7-5-6-17(12-18)25-4/h5-10,12H,11H2,1-4H3,(H,22,23,24)