[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl] 3-(3-cyano-6-phenyl-pyridin-2-yl)sulfanylpropanoate

Systemtic Name: [2-(4-methoxyphenyl)-2-oxidanylidene-ethyl] 3-(3-cyano-6-phenyl-pyridin-2-yl)sulfanylpropanoate Openeye Name: [2-(4-methoxyphenyl)-2-oxo-ethyl] 3-[(3-cyano-6-phenyl-2-pyridyl)sulfanyl]propanoate CAS Name: 3-[(3-cyano-6-phenyl-2-pyridinyl)thio]propanoic acid [2-(4-methoxyphenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-methoxyphenyl)-2-oxoethyl] 3-(3-cyano-6-phenylpyridin-2-yl)sulfanylpropanoate Traditional Name: 3-[(3-cyano-6-phenyl-2-pyridyl)thio]propionic acid [2-keto-2-(4-methoxyphenyl)ethyl] ester Formula: C24H20N2O4S MolecularWeight: 432.4916

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)COC(=O)CCSC2=C(C=CC(=N2)C3=CC=CC=C3)C#N

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)COC(=O)CCSC2=C(C=CC(=N2)C3=CC=CC=C3)C#N

InChI

InChI=1S/C24H20N2O4S/c1-29-20-10-7-18(8-11-20)22(27)16-30-23(28)13-14-31-24-19(15-25)9-12-21(26-24)17-5-3-2-4-6-17/h2-12H,13-14,16H2,1H3