ethyl 5-cyano-2-oxidanylidene-6-[2-oxidanylidene-2-(2-oxidanylidenechromen-3-yl)ethyl]sulfanyl-1H-pyridine-3-carboxylate

Systemtic Name: ethyl 5-cyano-2-oxidanylidene-6-[2-oxidanylidene-2-(2-oxidanylidenechromen-3-yl)ethyl]sulfanyl-1H-pyridine-3-carboxylate Openeye Name: ethyl 5-cyano-2-oxo-6-[2-oxo-2-(2-oxochromen-3-yl)ethyl]sulfanyl-1H-pyridine-3-carboxylate CAS Name: 5-cyano-2-oxo-6-[[2-oxo-2-(2-oxo-1-benzopyran-3-yl)ethyl]thio]-1H-pyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-cyano-2-oxo-6-[2-oxo-2-(2-oxochromen-3-yl)ethyl]sulfanyl-1H-pyridine-3-carboxylate Traditional Name: 5-cyano-2-keto-6-[[2-keto-2-(2-ketochromen-3-yl)ethyl]thio]-1H-pyridine-3-carboxylic acid ethyl ester Formula: C20H14N2O6S MolecularWeight: 410.39996

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(NC1=O)SCC(=O)C2=CC3=CC=CC=C3OC2=O)C#N

Isomeric SMILES

CCOC(=O)C1=CC(=C(NC1=O)SCC(=O)C2=CC3=CC=CC=C3OC2=O)C#N

InChI

InChI=1S/C20H14N2O6S/c1-2-27-19(25)14-8-12(9-21)18(22-17(14)24)29-10-15(23)13-7-11-5-3-4-6-16(11)28-20(13)26/h3-8H,2,10H2,1H3,(H,22,24)