ethyl 2-[(3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanyl]-3-oxidanylidene-butanoate

Systemtic Name: ethyl 2-[(3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanyl]-3-oxidanylidene-butanoate Openeye Name: ethyl 2-[(3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanyl]-3-oxo-butanoate CAS Name: 2-[(3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)thio]-3-oxobutanoic acid ethyl ester IUPAC Name: ethyl 2-[(3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanyl]-3-oxobutanoate Traditional Name: 2-[(3-cyano-1-pyrindan-2-yl)thio]-3-keto-butyric acid ethyl ester Formula: C15H16N2O3S MolecularWeight: 304.36414

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(=O)C)SC1=NC2=C(CCC2)C=C1C#N

Isomeric SMILES

CCOC(=O)C(C(=O)C)SC1=NC2=C(CCC2)C=C1C#N

InChI

InChI=1S/C15H16N2O3S/c1-3-20-15(19)13(9(2)18)21-14-11(8-16)7-10-5-4-6-12(10)17-14/h7,13H,3-6H2,1-2H3