[2-(cyclopentylamino)-2-oxidanylidene-ethyl] (2R)-2-[(4-chlorophenyl)carbonylamino]-4-methylsulfanyl-butanoate

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

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)OCC(=O)NC1CCCC1)NC(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CSCC[C@H](C(=O)OCC(=O)NC1CCCC1)NC(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C19H25ClN2O4S/c1-27-11-10-16(22-18(24)13-6-8-14(20)9-7-13)19(25)26-12-17(23)21-15-4-2-3-5-15/h6-9,15-16H,2-5,10-12H2,1H3,(H,21,23)(H,22,24)/t16-/m1/s1