ethyl 5-cyano-2-methyl-6-[2-oxidanylidene-2-(1-thiophen-2-ylethylamino)ethyl]sulfanyl-pyridine-3-carboxylate

Systemtic Name: ethyl 5-cyano-2-methyl-6-[2-oxidanylidene-2-(1-thiophen-2-ylethylamino)ethyl]sulfanyl-pyridine-3-carboxylate Openeye Name: ethyl 5-cyano-2-methyl-6-[2-oxo-2-[1-(2-thienyl)ethylamino]ethyl]sulfanyl-pyridine-3-carboxylate CAS Name: 5-cyano-2-methyl-6-[[2-oxo-2-(1-thiophen-2-ylethylamino)ethyl]thio]-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-cyano-2-methyl-6-[2-oxo-2-(1-thiophen-2-ylethylamino)ethyl]sulfanylpyridine-3-carboxylate Traditional Name: 5-cyano-6-[[2-keto-2-[1-(2-thienyl)ethylamino]ethyl]thio]-2-methyl-nicotinic acid ethyl ester Formula: C18H19N3O3S2 MolecularWeight: 389.49176

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(C(=C1)C#N)SCC(=O)NC(C)C2=CC=CS2)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(C(=C1)C#N)SCC(=O)NC(C)C2=CC=CS2)C

InChI

InChI=1S/C18H19N3O3S2/c1-4-24-18(23)14-8-13(9-19)17(21-11(14)2)26-10-16(22)20-12(3)15-6-5-7-25-15/h5-8,12H,4,10H2,1-3H3,(H,20,22)