6-[(3-methylphenyl)methyl]-2-methylsulfanyl-1H-pyrimidin-4-one

Systemtic Name: 6-[(3-methylphenyl)methyl]-2-methylsulfanyl-1H-pyrimidin-4-one Openeye Name: 2-methylsulfanyl-6-(m-tolylmethyl)-1H-pyrimidin-4-one CAS Name: 6-[(3-methylphenyl)methyl]-2-(methylthio)-1H-pyrimidin-4-one IUPAC Name: 6-[(3-methylphenyl)methyl]-2-methylsulfanyl-1H-pyrimidin-4-one Traditional Name: 6-(3-methylbenzyl)-2-(methylthio)-1H-pyrimidin-4-one Formula: C13H14N2OS MolecularWeight: 246.32806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CC2=CC(=O)N=C(N2)SC

Isomeric SMILES

CC1=CC(=CC=C1)CC2=CC(=O)N=C(N2)SC

InChI

InChI=1S/C13H14N2OS/c1-9-4-3-5-10(6-9)7-11-8-12(16)15-13(14-11)17-2/h3-6,8H,7H2,1-2H3,(H,14,15,16)