ethyl 4-[3-cyano-4-(3,4-dimethoxyphenyl)-6-thiophen-2-yl-pyridin-2-yl]sulfanyl-3-oxidanylidene-butanoate

Systemtic Name: ethyl 4-[3-cyano-4-(3,4-dimethoxyphenyl)-6-thiophen-2-yl-pyridin-2-yl]sulfanyl-3-oxidanylidene-butanoate Openeye Name: ethyl 4-[[3-cyano-4-(3,4-dimethoxyphenyl)-6-(2-thienyl)-2-pyridyl]sulfanyl]-3-oxo-butanoate CAS Name: 4-[[3-cyano-4-(3,4-dimethoxyphenyl)-6-thiophen-2-yl-2-pyridinyl]thio]-3-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-[3-cyano-4-(3,4-dimethoxyphenyl)-6-thiophen-2-ylpyridin-2-yl]sulfanyl-3-oxobutanoate Traditional Name: 4-[[3-cyano-4-(3,4-dimethoxyphenyl)-6-(2-thienyl)-2-pyridyl]thio]-3-keto-butyric acid ethyl ester Formula: C24H22N2O5S2 MolecularWeight: 482.57188

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(=O)CSC1=C(C(=CC(=N1)C2=CC=CS2)C3=CC(=C(C=C3)OC)OC)C#N

Isomeric SMILES

CCOC(=O)CC(=O)CSC1=C(C(=CC(=N1)C2=CC=CS2)C3=CC(=C(C=C3)OC)OC)C#N

InChI

InChI=1S/C24H22N2O5S2/c1-4-31-23(28)11-16(27)14-33-24-18(13-25)17(12-19(26-24)22-6-5-9-32-22)15-7-8-20(29-2)21(10-15)30-3/h5-10,12H,4,11,14H2,1-3H3