5,6-dimethyl-2-[(4-methylphenyl)methylsulfanyl]-1H-pyrimidin-4-one

Systemtic Name: 5,6-dimethyl-2-[(4-methylphenyl)methylsulfanyl]-1H-pyrimidin-4-one Openeye Name: 5,6-dimethyl-2-(p-tolylmethylsulfanyl)-1H-pyrimidin-4-one CAS Name: 5,6-dimethyl-2-[(4-methylphenyl)methylthio]-1H-pyrimidin-4-one IUPAC Name: 5,6-dimethyl-2-[(4-methylphenyl)methylsulfanyl]-1H-pyrimidin-4-one Traditional Name: 5,6-dimethyl-2-[(4-methylbenzyl)thio]-1H-pyrimidin-4-one Formula: C14H16N2OS MolecularWeight: 260.35464

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H16N2OS/c1-9-4-6-12(7-5-9)8-18-14-15-11(3)10(2)13(17)16-14/h4-7H,8H2,1-3H3,(H,15,16,17)