6-methyl-2-(4-methylphenyl)-5-(2-propan-2-ylsulfanylethyl)-1H-pyrimidin-4-one

Systemtic Name: 6-methyl-2-(4-methylphenyl)-5-(2-propan-2-ylsulfanylethyl)-1H-pyrimidin-4-one Openeye Name: 5-(2-isopropylsulfanylethyl)-6-methyl-2-(p-tolyl)-1H-pyrimidin-4-one CAS Name: 6-methyl-2-(4-methylphenyl)-5-[2-(propan-2-ylthio)ethyl]-1H-pyrimidin-4-one IUPAC Name: 6-methyl-2-(4-methylphenyl)-5-(2-propan-2-ylsulfanylethyl)-1H-pyrimidin-4-one Traditional Name: 5-[2-(isopropylthio)ethyl]-6-methyl-2-(p-tolyl)-1H-pyrimidin-4-one Formula: C17H22N2OS MolecularWeight: 302.43438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=O)C(=C(N2)C)CCSC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=O)C(=C(N2)C)CCSC(C)C

InChI

InChI=1S/C17H22N2OS/c1-11(2)21-10-9-15-13(4)18-16(19-17(15)20)14-7-5-12(3)6-8-14/h5-8,11H,9-10H2,1-4H3,(H,18,19,20)