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

Systemtic Name: [2-(cyclopentylamino)-2-oxidanylidene-ethyl] (2R)-4-methylsulfanyl-2-(phenylsulfonylamino)butanoate Openeye Name: [2-(cyclopentylamino)-2-oxo-ethyl] (2R)-2-(benzenesulfonamido)-4-methylsulfanyl-butanoate CAS Name: (2R)-2-(benzenesulfonamido)-4-(methylthio)butanoic acid [2-(cyclopentylamino)-2-oxoethyl] ester IUPAC Name: [2-(cyclopentylamino)-2-oxoethyl] (2R)-2-(benzenesulfonamido)-4-methylsulfanylbutanoate Traditional Name: (2R)-2-(benzenesulfonamido)-4-(methylthio)butyric acid [2-(cyclopentylamino)-2-keto-ethyl] ester Formula: C18H26N2O5S2 MolecularWeight: 414.53944

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)OCC(=O)NC1CCCC1)NS(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

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

InChI

InChI=1S/C18H26N2O5S2/c1-26-12-11-16(20-27(23,24)15-9-3-2-4-10-15)18(22)25-13-17(21)19-14-7-5-6-8-14/h2-4,9-10,14,16,20H,5-8,11-13H2,1H3,(H,19,21)/t16-/m1/s1