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

Systemtic Name: 2-(3,5-dimethylphenyl)sulfanyl-5-methyl-6-(phenylmethyl)-1H-pyrimidin-4-one Openeye Name: 6-benzyl-2-(3,5-dimethylphenyl)sulfanyl-5-methyl-1H-pyrimidin-4-one CAS Name: 2-[(3,5-dimethylphenyl)thio]-5-methyl-6-(phenylmethyl)-1H-pyrimidin-4-one IUPAC Name: 6-benzyl-2-(3,5-dimethylphenyl)sulfanyl-5-methyl-1H-pyrimidin-4-one Traditional Name: 6-benzyl-2-[(3,5-dimethylphenyl)thio]-5-methyl-1H-pyrimidin-4-one Formula: C20H20N2OS MolecularWeight: 336.4506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)SC2=NC(=O)C(=C(N2)CC3=CC=CC=C3)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)SC2=NC(=O)C(=C(N2)CC3=CC=CC=C3)C)C

InChI

InChI=1S/C20H20N2OS/c1-13-9-14(2)11-17(10-13)24-20-21-18(15(3)19(23)22-20)12-16-7-5-4-6-8-16/h4-11H,12H2,1-3H3,(H,21,22,23)