2-(2-methylsulfanylphenyl)-6-oxidanylidene-1H-pyrimidine-5-carbonitrile

Systemtic Name: 2-(2-methylsulfanylphenyl)-6-oxidanylidene-1H-pyrimidine-5-carbonitrile Openeye Name: 2-(2-methylsulfanylphenyl)-6-oxo-1H-pyrimidine-5-carbonitrile CAS Name: 2-[2-(methylthio)phenyl]-6-oxo-1H-pyrimidine-5-carbonitrile IUPAC Name: 2-(2-methylsulfanylphenyl)-6-oxo-1H-pyrimidine-5-carbonitrile Traditional Name: 6-keto-2-[2-(methylthio)phenyl]-1H-pyrimidine-5-carbonitrile Formula: C12H9N3OS MolecularWeight: 243.28436

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1C2=NC=C(C(=O)N2)C#N

Isomeric SMILES

CSC1=CC=CC=C1C2=NC=C(C(=O)N2)C#N

InChI

InChI=1S/C12H9N3OS/c1-17-10-5-3-2-4-9(10)11-14-7-8(6-13)12(16)15-11/h2-5,7H,1H3,(H,14,15,16)