methyl 5-cyano-1-[2-[[3-ethoxycarbonyl-4-(furan-2-yl)thiophen-2-yl]amino]-2-oxidanylidene-ethyl]-6-oxidanylidene-pyridine-3-carboxylate

Systemtic Name: methyl 5-cyano-1-[2-[[3-ethoxycarbonyl-4-(furan-2-yl)thiophen-2-yl]amino]-2-oxidanylidene-ethyl]-6-oxidanylidene-pyridine-3-carboxylate Openeye Name: methyl 5-cyano-1-[2-[[3-ethoxycarbonyl-4-(2-furyl)-2-thienyl]amino]-2-oxo-ethyl]-6-oxo-pyridine-3-carboxylate CAS Name: 5-cyano-1-[2-[[3-ethoxycarbonyl-4-(2-furanyl)-2-thiophenyl]amino]-2-oxoethyl]-6-oxo-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 5-cyano-1-[2-[[3-ethoxycarbonyl-4-(furan-2-yl)thiophen-2-yl]amino]-2-oxoethyl]-6-oxopyridine-3-carboxylate Traditional Name: 1-[2-[[3-carbethoxy-4-(2-furyl)-2-thienyl]amino]-2-keto-ethyl]-5-cyano-6-keto-nicotinic acid methyl ester Formula: C21H17N3O7S MolecularWeight: 455.44058

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=CO2)NC(=O)CN3C=C(C=C(C3=O)C#N)C(=O)OC

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=CO2)NC(=O)CN3C=C(C=C(C3=O)C#N)C(=O)OC

InChI

InChI=1S/C21H17N3O7S/c1-3-30-21(28)17-14(15-5-4-6-31-15)11-32-18(17)23-16(25)10-24-9-13(20(27)29-2)7-12(8-22)19(24)26/h4-7,9,11H,3,10H2,1-2H3,(H,23,25)