3-(6-methylpyridin-3-yl)-2-(4-methylsulfanylphenyl)-3-oxidanylidene-propanenitrile

Systemtic Name: 3-(6-methylpyridin-3-yl)-2-(4-methylsulfanylphenyl)-3-oxidanylidene-propanenitrile Openeye Name: 3-(6-methyl-3-pyridyl)-2-(4-methylsulfanylphenyl)-3-oxo-propanenitrile CAS Name: 3-(6-methyl-3-pyridinyl)-2-[4-(methylthio)phenyl]-3-oxopropanenitrile IUPAC Name: 3-(6-methylpyridin-3-yl)-2-(4-methylsulfanylphenyl)-3-oxopropanenitrile Traditional Name: 3-keto-3-(6-methyl-3-pyridyl)-2-[4-(methylthio)phenyl]propionitrile Formula: C16H14N2OS MolecularWeight: 282.36016

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14N2OS/c1-11-3-4-13(10-18-11)16(19)15(9-17)12-5-7-14(20-2)8-6-12/h3-8,10,15H,1-2H3