ethyl 5-cyano-6-[2-[(3-cyanothiophen-2-yl)amino]-2-oxidanylidene-ethyl]sulfanyl-2-methyl-pyridine-3-carboxylate

Systemtic Name: ethyl 5-cyano-6-[2-[(3-cyanothiophen-2-yl)amino]-2-oxidanylidene-ethyl]sulfanyl-2-methyl-pyridine-3-carboxylate Openeye Name: ethyl 5-cyano-6-[2-[(3-cyano-2-thienyl)amino]-2-oxo-ethyl]sulfanyl-2-methyl-pyridine-3-carboxylate CAS Name: 5-cyano-6-[[2-[(3-cyano-2-thiophenyl)amino]-2-oxoethyl]thio]-2-methyl-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-cyano-6-[2-[(3-cyanothiophen-2-yl)amino]-2-oxoethyl]sulfanyl-2-methylpyridine-3-carboxylate Traditional Name: 5-cyano-6-[[2-[(3-cyano-2-thienyl)amino]-2-keto-ethyl]thio]-2-methyl-nicotinic acid ethyl ester Formula: C17H14N4O3S2 MolecularWeight: 386.44806

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(C(=C1)C#N)SCC(=O)NC2=C(C=CS2)C#N)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(C(=C1)C#N)SCC(=O)NC2=C(C=CS2)C#N)C

InChI

InChI=1S/C17H14N4O3S2/c1-3-24-17(23)13-6-12(8-19)16(20-10(13)2)26-9-14(22)21-15-11(7-18)4-5-25-15/h4-6H,3,9H2,1-2H3,(H,21,22)