[2-(cyclopropylamino)-2-oxidanylidene-ethyl] (2R)-4-methylsulfanyl-2-(phenylsulfonylamino)butanoate

Systemtic Name: [2-(cyclopropylamino)-2-oxidanylidene-ethyl] (2R)-4-methylsulfanyl-2-(phenylsulfonylamino)butanoate Openeye Name: [2-(cyclopropylamino)-2-oxo-ethyl] (2R)-2-(benzenesulfonamido)-4-methylsulfanyl-butanoate CAS Name: (2R)-2-(benzenesulfonamido)-4-(methylthio)butanoic acid [2-(cyclopropylamino)-2-oxoethyl] ester IUPAC Name: [2-(cyclopropylamino)-2-oxoethyl] (2R)-2-(benzenesulfonamido)-4-methylsulfanylbutanoate Traditional Name: (2R)-2-(benzenesulfonamido)-4-(methylthio)butyric acid [2-(cyclopropylamino)-2-keto-ethyl] ester Formula: C16H22N2O5S2 MolecularWeight: 386.48628

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)OCC(=O)NC1CC1)NS(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CSCC[C@H](C(=O)OCC(=O)NC1CC1)NS(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C16H22N2O5S2/c1-24-10-9-14(16(20)23-11-15(19)17-12-7-8-12)18-25(21,22)13-5-3-2-4-6-13/h2-6,12,14,18H,7-11H2,1H3,(H,17,19)/t14-/m1/s1