ethyl 2-[(3-cyano-5-ethanoyl-6-methyl-4-thiophen-2-yl-3,4-dihydropyridin-2-yl)sulfanyl]-3-oxidanylidene-butanoate

Systemtic Name: ethyl 2-[(3-cyano-5-ethanoyl-6-methyl-4-thiophen-2-yl-3,4-dihydropyridin-2-yl)sulfanyl]-3-oxidanylidene-butanoate Openeye Name: ethyl 2-[[5-acetyl-3-cyano-6-methyl-4-(2-thienyl)-3,4-dihydropyridin-2-yl]sulfanyl]-3-oxo-butanoate CAS Name: 2-[(5-acetyl-3-cyano-6-methyl-4-thiophen-2-yl-3,4-dihydropyridin-2-yl)thio]-3-oxobutanoic acid ethyl ester IUPAC Name: ethyl 2-[(5-acetyl-3-cyano-6-methyl-4-thiophen-2-yl-3,4-dihydropyridin-2-yl)sulfanyl]-3-oxobutanoate Traditional Name: 2-[[5-acetyl-3-cyano-6-methyl-4-(2-thienyl)-3,4-dihydropyridin-2-yl]thio]-3-keto-butyric acid ethyl ester Formula: C19H20N2O4S2 MolecularWeight: 404.5031

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(=O)C)SC1=NC(=C(C(C1C#N)C2=CC=CS2)C(=O)C)C

Isomeric SMILES

CCOC(=O)C(C(=O)C)SC1=NC(=C(C(C1C#N)C2=CC=CS2)C(=O)C)C

InChI

InChI=1S/C19H20N2O4S2/c1-5-25-19(24)17(12(4)23)27-18-13(9-20)16(14-7-6-8-26-14)15(11(3)22)10(2)21-18/h6-8,13,16-17H,5H2,1-4H3