methyl 4-(3-cyano-4,6-dithiophen-2-yl-pyridin-2-yl)sulfanyl-3-oxidanylidene-butanoate

Systemtic Name: methyl 4-(3-cyano-4,6-dithiophen-2-yl-pyridin-2-yl)sulfanyl-3-oxidanylidene-butanoate Openeye Name: methyl 4-[[3-cyano-4,6-bis(2-thienyl)-2-pyridyl]sulfanyl]-3-oxo-butanoate CAS Name: 4-[(3-cyano-4,6-dithiophen-2-yl-2-pyridinyl)thio]-3-oxobutanoic acid methyl ester IUPAC Name: methyl 4-(3-cyano-4,6-dithiophen-2-ylpyridin-2-yl)sulfanyl-3-oxobutanoate Traditional Name: 4-[[3-cyano-4,6-bis(2-thienyl)-2-pyridyl]thio]-3-keto-butyric acid methyl ester Formula: C19H14N2O3S3 MolecularWeight: 414.52106

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(=O)CSC1=C(C(=CC(=N1)C2=CC=CS2)C3=CC=CS3)C#N

Isomeric SMILES

COC(=O)CC(=O)CSC1=C(C(=CC(=N1)C2=CC=CS2)C3=CC=CS3)C#N

InChI

InChI=1S/C19H14N2O3S3/c1-24-18(23)8-12(22)11-27-19-14(10-20)13(16-4-2-6-25-16)9-15(21-19)17-5-3-7-26-17/h2-7,9H,8,11H2,1H3