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

Systemtic Name: 2-(4-methylphenyl)-4-methylsulfanyl-6-oxidanylidene-1H-pyrimidine-5-carbonitrile Openeye Name: 4-methylsulfanyl-6-oxo-2-(p-tolyl)-1H-pyrimidine-5-carbonitrile CAS Name: 2-(4-methylphenyl)-4-(methylthio)-6-oxo-1H-pyrimidine-5-carbonitrile IUPAC Name: 2-(4-methylphenyl)-4-methylsulfanyl-6-oxo-1H-pyrimidine-5-carbonitrile Traditional Name: 6-keto-4-(methylthio)-2-(p-tolyl)-1H-pyrimidine-5-carbonitrile Formula: C13H11N3OS MolecularWeight: 257.31094

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=C(C(=O)N2)C#N)SC

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=C(C(=O)N2)C#N)SC

InChI

InChI=1S/C13H11N3OS/c1-8-3-5-9(6-4-8)11-15-12(17)10(7-14)13(16-11)18-2/h3-6H,1-2H3,(H,15,16,17)