[2-(dimethylamino)-2-oxidanylidene-ethyl] (2S)-4-methylsulfanyl-2-(phenylsulfonylamino)butanoate

Systemtic Name: [2-(dimethylamino)-2-oxidanylidene-ethyl] (2S)-4-methylsulfanyl-2-(phenylsulfonylamino)butanoate Openeye Name: [2-(dimethylamino)-2-oxo-ethyl] (2S)-2-(benzenesulfonamido)-4-methylsulfanyl-butanoate CAS Name: (2S)-2-(benzenesulfonamido)-4-(methylthio)butanoic acid [2-(dimethylamino)-2-oxoethyl] ester IUPAC Name: [2-(dimethylamino)-2-oxoethyl] (2S)-2-(benzenesulfonamido)-4-methylsulfanylbutanoate Traditional Name: (2S)-2-(benzenesulfonamido)-4-(methylthio)butyric acid [2-(dimethylamino)-2-keto-ethyl] ester Formula: C15H22N2O5S2 MolecularWeight: 374.47558

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)COC(=O)C(CCSC)NS(=O)(=O)C1=CC=CC=C1

Isomeric SMILES

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

InChI

InChI=1S/C15H22N2O5S2/c1-17(2)14(18)11-22-15(19)13(9-10-23-3)16-24(20,21)12-7-5-4-6-8-12/h4-8,13,16H,9-11H2,1-3H3/t13-/m0/s1