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

Systemtic Name: 2-(4-methoxyphenyl)-4-methylsulfanyl-6-oxidanylidene-1H-pyrimidine-5-carbonitrile Openeye Name: 2-(4-methoxyphenyl)-4-methylsulfanyl-6-oxo-1H-pyrimidine-5-carbonitrile CAS Name: 2-(4-methoxyphenyl)-4-(methylthio)-6-oxo-1H-pyrimidine-5-carbonitrile IUPAC Name: 2-(4-methoxyphenyl)-4-methylsulfanyl-6-oxo-1H-pyrimidine-5-carbonitrile Traditional Name: 6-keto-2-(4-methoxyphenyl)-4-(methylthio)-1H-pyrimidine-5-carbonitrile Formula: C13H11N3O2S MolecularWeight: 273.31034

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC(=C(C(=O)N2)C#N)SC

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC(=C(C(=O)N2)C#N)SC

InChI

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