[2-[(1-cyanocyclopentyl)amino]-2-oxidanylidene-ethyl] 2-[(R)-ethylsulfinyl]benzoate

Systemtic Name: [2-[(1-cyanocyclopentyl)amino]-2-oxidanylidene-ethyl] 2-[(R)-ethylsulfinyl]benzoate Openeye Name: [2-[(1-cyanocyclopentyl)amino]-2-oxo-ethyl] 2-[(R)-ethylsulfinyl]benzoate CAS Name: 2-[(R)-ethylsulfinyl]benzoic acid [2-[(1-cyanocyclopentyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(1-cyanocyclopentyl)amino]-2-oxoethyl] 2-[(R)-ethylsulfinyl]benzoate Traditional Name: 2-[(R)-ethylsulfinyl]benzoic acid [2-[(1-cyanocyclopentyl)amino]-2-keto-ethyl] ester Formula: C17H20N2O4S MolecularWeight: 348.4167

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)C1=CC=CC=C1C(=O)OCC(=O)NC2(CCCC2)C#N

Isomeric SMILES

CC[S@@](=O)C1=CC=CC=C1C(=O)OCC(=O)NC2(CCCC2)C#N

InChI

InChI=1S/C17H20N2O4S/c1-2-24(22)14-8-4-3-7-13(14)16(21)23-11-15(20)19-17(12-18)9-5-6-10-17/h3-4,7-8H,2,5-6,9-11H2,1H3,(H,19,20)/t24-/m1/s1