[2-oxidanylidene-2-(propan-2-ylamino)ethyl] (2S)-2-[(4-chlorophenyl)sulfonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: [2-oxidanylidene-2-(propan-2-ylamino)ethyl] (2S)-2-[(4-chlorophenyl)sulfonylamino]-4-methylsulfanyl-butanoate Openeye Name: [2-(isopropylamino)-2-oxo-ethyl] (2S)-2-[(4-chlorophenyl)sulfonylamino]-4-methylsulfanyl-butanoate CAS Name: (2S)-2-[(4-chlorophenyl)sulfonylamino]-4-(methylthio)butanoic acid [2-oxo-2-(propan-2-ylamino)ethyl] ester IUPAC Name: [2-oxo-2-(propan-2-ylamino)ethyl] (2S)-2-[(4-chlorophenyl)sulfonylamino]-4-methylsulfanylbutanoate Traditional Name: (2S)-2-[(4-chlorophenyl)sulfonylamino]-4-(methylthio)butyric acid [2-(isopropylamino)-2-keto-ethyl] ester Formula: C16H23ClN2O5S2 MolecularWeight: 422.94722

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)COC(=O)C(CCSC)NS(=O)(=O)C1=CC=C(C=C1)Cl

Isomeric SMILES

CC(C)NC(=O)COC(=O)[C@H](CCSC)NS(=O)(=O)C1=CC=C(C=C1)Cl

InChI

InChI=1S/C16H23ClN2O5S2/c1-11(2)18-15(20)10-24-16(21)14(8-9-25-3)19-26(22,23)13-6-4-12(17)5-7-13/h4-7,11,14,19H,8-10H2,1-3H3,(H,18,20)/t14-/m0/s1