ethyl 5-cyano-6-[2-(furan-2-ylmethylcarbamoylamino)-2-oxidanylidene-ethyl]sulfanyl-2-methyl-pyridine-3-carboxylate

Systemtic Name: ethyl 5-cyano-6-[2-(furan-2-ylmethylcarbamoylamino)-2-oxidanylidene-ethyl]sulfanyl-2-methyl-pyridine-3-carboxylate Openeye Name: ethyl 5-cyano-6-[2-(2-furylmethylcarbamoylamino)-2-oxo-ethyl]sulfanyl-2-methyl-pyridine-3-carboxylate CAS Name: 5-cyano-6-[[2-[[(2-furanylmethylamino)-oxomethyl]amino]-2-oxoethyl]thio]-2-methyl-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-cyano-6-[2-(furan-2-ylmethylcarbamoylamino)-2-oxoethyl]sulfanyl-2-methylpyridine-3-carboxylate Traditional Name: 5-cyano-6-[[2-(2-furfurylcarbamoylamino)-2-keto-ethyl]thio]-2-methyl-nicotinic acid ethyl ester Formula: C18H18N4O5S MolecularWeight: 402.42432

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(C(=C1)C#N)SCC(=O)NC(=O)NCC2=CC=CO2)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(C(=C1)C#N)SCC(=O)NC(=O)NCC2=CC=CO2)C

InChI

InChI=1S/C18H18N4O5S/c1-3-26-17(24)14-7-12(8-19)16(21-11(14)2)28-10-15(23)22-18(25)20-9-13-5-4-6-27-13/h4-7H,3,9-10H2,1-2H3,(H2,20,22,23,25)