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

Systemtic Name: 6-(2,4-dimethylphenyl)-2-methylsulfanyl-4-oxidanylidene-1H-pyrimidine-5-carbonitrile Openeye Name: 6-(2,4-dimethylphenyl)-2-methylsulfanyl-4-oxo-1H-pyrimidine-5-carbonitrile CAS Name: 6-(2,4-dimethylphenyl)-2-(methylthio)-4-oxo-1H-pyrimidine-5-carbonitrile IUPAC Name: 6-(2,4-dimethylphenyl)-2-methylsulfanyl-4-oxo-1H-pyrimidine-5-carbonitrile Traditional Name: 6-(2,4-dimethylphenyl)-4-keto-2-(methylthio)-1H-pyrimidine-5-carbonitrile Formula: C14H13N3OS MolecularWeight: 271.33752

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13N3OS/c1-8-4-5-10(9(2)6-8)12-11(7-15)13(18)17-14(16-12)19-3/h4-6H,1-3H3,(H,16,17,18)