[2-(cyclopropylamino)-2-oxidanylidene-ethyl] (2S)-3-methyl-2-(thiophen-2-ylsulfonylamino)butanoate

Systemtic Name: [2-(cyclopropylamino)-2-oxidanylidene-ethyl] (2S)-3-methyl-2-(thiophen-2-ylsulfonylamino)butanoate Openeye Name: [2-(cyclopropylamino)-2-oxo-ethyl] (2S)-3-methyl-2-(2-thienylsulfonylamino)butanoate CAS Name: (2S)-3-methyl-2-(thiophen-2-ylsulfonylamino)butanoic acid [2-(cyclopropylamino)-2-oxoethyl] ester IUPAC Name: [2-(cyclopropylamino)-2-oxoethyl] (2S)-3-methyl-2-(thiophen-2-ylsulfonylamino)butanoate Traditional Name: (2S)-3-methyl-2-(2-thienylsulfonylamino)butyric acid [2-(cyclopropylamino)-2-keto-ethyl] ester Formula: C14H20N2O5S2 MolecularWeight: 360.449

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC(=O)NC1CC1)NS(=O)(=O)C2=CC=CS2

Isomeric SMILES

CC(C)[C@@H](C(=O)OCC(=O)NC1CC1)NS(=O)(=O)C2=CC=CS2

InChI

InChI=1S/C14H20N2O5S2/c1-9(2)13(16-23(19,20)12-4-3-7-22-12)14(18)21-8-11(17)15-10-5-6-10/h3-4,7,9-10,13,16H,5-6,8H2,1-2H3,(H,15,17)/t13-/m0/s1