4-methyl-2-[2-(4-methylphenyl)-2-oxidanylidene-ethyl]sulfanyl-pyridine-3-carbonitrile

Systemtic Name: 4-methyl-2-[2-(4-methylphenyl)-2-oxidanylidene-ethyl]sulfanyl-pyridine-3-carbonitrile Openeye Name: 4-methyl-2-[2-oxo-2-(p-tolyl)ethyl]sulfanyl-pyridine-3-carbonitrile CAS Name: 4-methyl-2-[[2-(4-methylphenyl)-2-oxoethyl]thio]-3-pyridinecarbonitrile IUPAC Name: 4-methyl-2-[2-(4-methylphenyl)-2-oxoethyl]sulfanylpyridine-3-carbonitrile Traditional Name: 2-[[2-keto-2-(p-tolyl)ethyl]thio]-4-methyl-nicotinonitrile Formula: C16H14N2OS MolecularWeight: 282.36016

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)CSC2=NC=CC(=C2C#N)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)CSC2=NC=CC(=C2C#N)C

InChI

InChI=1S/C16H14N2OS/c1-11-3-5-13(6-4-11)15(19)10-20-16-14(9-17)12(2)7-8-18-16/h3-8H,10H2,1-2H3