(2-oxidanylidene-2-piperidin-1-yl-ethyl) (2R)-2-[(4-chlorophenyl)carbonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: (2-oxidanylidene-2-piperidin-1-yl-ethyl) (2R)-2-[(4-chlorophenyl)carbonylamino]-4-methylsulfanyl-butanoate Openeye Name: [2-oxo-2-(1-piperidyl)ethyl] (2R)-2-[(4-chlorobenzoyl)amino]-4-methylsulfanyl-butanoate CAS Name: (2R)-2-[[(4-chlorophenyl)-oxomethyl]amino]-4-(methylthio)butanoic acid [2-oxo-2-(1-piperidinyl)ethyl] ester IUPAC Name: (2-oxo-2-piperidin-1-ylethyl) (2R)-2-[(4-chlorobenzoyl)amino]-4-methylsulfanylbutanoate Traditional Name: (2R)-2-[(4-chlorobenzoyl)amino]-4-(methylthio)butyric acid (2-keto-2-piperidino-ethyl) ester Formula: C19H25ClN2O4S MolecularWeight: 412.9308

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)OCC(=O)N1CCCCC1)NC(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CSCC[C@H](C(=O)OCC(=O)N1CCCCC1)NC(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C19H25ClN2O4S/c1-27-12-9-16(21-18(24)14-5-7-15(20)8-6-14)19(25)26-13-17(23)22-10-3-2-4-11-22/h5-8,16H,2-4,9-13H2,1H3,(H,21,24)/t16-/m1/s1