5-ethanoyl-2-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-6-methyl-pyridine-3-carbonitrile

Systemtic Name: 5-ethanoyl-2-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-6-methyl-pyridine-3-carbonitrile Openeye Name: 5-acetyl-2-[2-(4-methoxyphenyl)-2-oxo-ethyl]sulfanyl-6-methyl-pyridine-3-carbonitrile CAS Name: 5-acetyl-2-[[2-(4-methoxyphenyl)-2-oxoethyl]thio]-6-methyl-3-pyridinecarbonitrile IUPAC Name: 5-acetyl-2-[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl-6-methylpyridine-3-carbonitrile Traditional Name: 5-acetyl-2-[[2-keto-2-(4-methoxyphenyl)ethyl]thio]-6-methyl-nicotinonitrile Formula: C18H16N2O3S MolecularWeight: 340.39624

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=N1)SCC(=O)C2=CC=C(C=C2)OC)C#N)C(=O)C

Isomeric SMILES

CC1=C(C=C(C(=N1)SCC(=O)C2=CC=C(C=C2)OC)C#N)C(=O)C

InChI

InChI=1S/C18H16N2O3S/c1-11-16(12(2)21)8-14(9-19)18(20-11)24-10-17(22)13-4-6-15(23-3)7-5-13/h4-8H,10H2,1-3H3