ethyl 4-(3-cyano-6-methyl-4-thiophen-3-yl-pyridin-2-yl)sulfanyl-3-oxidanylidene-butanoate

Systemtic Name: ethyl 4-(3-cyano-6-methyl-4-thiophen-3-yl-pyridin-2-yl)sulfanyl-3-oxidanylidene-butanoate Openeye Name: ethyl 4-[[3-cyano-6-methyl-4-(3-thienyl)-2-pyridyl]sulfanyl]-3-oxo-butanoate CAS Name: 4-[[3-cyano-6-methyl-4-(3-thiophenyl)-2-pyridinyl]thio]-3-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-(3-cyano-6-methyl-4-thiophen-3-ylpyridin-2-yl)sulfanyl-3-oxobutanoate Traditional Name: 4-[[3-cyano-6-methyl-4-(3-thienyl)-2-pyridyl]thio]-3-keto-butyric acid ethyl ester Formula: C17H16N2O3S2 MolecularWeight: 360.45054

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(=O)CSC1=C(C(=CC(=N1)C)C2=CSC=C2)C#N

Isomeric SMILES

CCOC(=O)CC(=O)CSC1=C(C(=CC(=N1)C)C2=CSC=C2)C#N

InChI

InChI=1S/C17H16N2O3S2/c1-3-22-16(21)7-13(20)10-24-17-15(8-18)14(6-11(2)19-17)12-4-5-23-9-12/h4-6,9H,3,7,10H2,1-2H3