ethyl 4-[6-azanyl-5-cyano-2-(furan-2-yl)pyridin-3-yl]-2-(3-oxidanylidene-2,6-dihydropyridin-1-yl)butanoate

Systemtic Name: ethyl 4-[6-azanyl-5-cyano-2-(furan-2-yl)pyridin-3-yl]-2-(3-oxidanylidene-2,6-dihydropyridin-1-yl)butanoate Openeye Name: ethyl 4-[6-amino-5-cyano-2-(2-furyl)-3-pyridyl]-2-(3-oxo-2,6-dihydropyridin-1-yl)butanoate CAS Name: 4-[6-amino-5-cyano-2-(2-furanyl)-3-pyridinyl]-2-(3-oxo-2,6-dihydropyridin-1-yl)butanoic acid ethyl ester IUPAC Name: ethyl 4-[6-amino-5-cyano-2-(furan-2-yl)pyridin-3-yl]-2-(3-oxo-2,6-dihydropyridin-1-yl)butanoate Traditional Name: 4-[6-amino-5-cyano-2-(2-furyl)-3-pyridyl]-2-(3-keto-2,6-dihydropyridin-1-yl)butyric acid ethyl ester Formula: C21H22N4O4 MolecularWeight: 394.42378

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCC1=C(N=C(C(=C1)C#N)N)C2=CC=CO2)N3CC=CC(=O)C3

Isomeric SMILES

CCOC(=O)C(CCC1=C(N=C(C(=C1)C#N)N)C2=CC=CO2)N3CC=CC(=O)C3

InChI

InChI=1S/C21H22N4O4/c1-2-28-21(27)17(25-9-3-5-16(26)13-25)8-7-14-11-15(12-22)20(23)24-19(14)18-6-4-10-29-18/h3-6,10-11,17H,2,7-9,13H2,1H3,(H2,23,24)