3-(2-methylphenyl)-6-methylsulfanyl-2,4-bis(oxidanylidene)-1H-pyrimidine-5-carbonitrile

Systemtic Name: 3-(2-methylphenyl)-6-methylsulfanyl-2,4-bis(oxidanylidene)-1H-pyrimidine-5-carbonitrile Openeye Name: 6-methylsulfanyl-3-(o-tolyl)-2,4-dioxo-1H-pyrimidine-5-carbonitrile CAS Name: 3-(2-methylphenyl)-6-(methylthio)-2,4-dioxo-1H-pyrimidine-5-carbonitrile IUPAC Name: 3-(2-methylphenyl)-6-methylsulfanyl-2,4-dioxo-1H-pyrimidine-5-carbonitrile Traditional Name: 2,4-diketo-6-(methylthio)-3-(o-tolyl)-1H-pyrimidine-5-carbonitrile Formula: C13H11N3O2S MolecularWeight: 273.31034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=O)C(=C(NC2=O)SC)C#N

Isomeric SMILES

CC1=CC=CC=C1N2C(=O)C(=C(NC2=O)SC)C#N

InChI

InChI=1S/C13H11N3O2S/c1-8-5-3-4-6-10(8)16-12(17)9(7-14)11(19-2)15-13(16)18/h3-6H,1-2H3,(H,15,18)