ethyl 5-cyano-6-ethylsulfanyl-4-(2-nitrophenyl)-2-oxidanylidene-3,4-dihydro-1H-pyridine-3-carboxylate

Systemtic Name: ethyl 5-cyano-6-ethylsulfanyl-4-(2-nitrophenyl)-2-oxidanylidene-3,4-dihydro-1H-pyridine-3-carboxylate Openeye Name: ethyl 5-cyano-6-ethylsulfanyl-4-(2-nitrophenyl)-2-oxo-3,4-dihydro-1H-pyridine-3-carboxylate CAS Name: 5-cyano-6-(ethylthio)-4-(2-nitrophenyl)-2-oxo-3,4-dihydro-1H-pyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-cyano-6-ethylsulfanyl-4-(2-nitrophenyl)-2-oxo-3,4-dihydro-1H-pyridine-3-carboxylate Traditional Name: 5-cyano-6-(ethylthio)-2-keto-4-(2-nitrophenyl)-3,4-dihydro-1H-pyridine-3-carboxylic acid ethyl ester Formula: C17H17N3O5S MolecularWeight: 375.39898

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(C(=C(NC1=O)SCC)C#N)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1C(C(=C(NC1=O)SCC)C#N)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C17H17N3O5S/c1-3-25-17(22)14-13(10-7-5-6-8-12(10)20(23)24)11(9-18)16(26-4-2)19-15(14)21/h5-8,13-14H,3-4H2,1-2H3,(H,19,21)