[(2S)-1-(cyclohexylamino)-1-oxidanylidene-propan-2-yl] 3-(thiophen-2-ylsulfonylamino)propanoate

Systemtic Name: [(2S)-1-(cyclohexylamino)-1-oxidanylidene-propan-2-yl] 3-(thiophen-2-ylsulfonylamino)propanoate Openeye Name: [(1S)-2-(cyclohexylamino)-1-methyl-2-oxo-ethyl] 3-(2-thienylsulfonylamino)propanoate CAS Name: 3-(thiophen-2-ylsulfonylamino)propanoic acid [(2S)-1-(cyclohexylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(cyclohexylamino)-1-oxopropan-2-yl] 3-(thiophen-2-ylsulfonylamino)propanoate Traditional Name: 3-(2-thienylsulfonylamino)propionic acid [(1S)-2-(cyclohexylamino)-2-keto-1-methyl-ethyl] ester Formula: C16H24N2O5S2 MolecularWeight: 388.50216

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCCCC1)OC(=O)CCNS(=O)(=O)C2=CC=CS2

Isomeric SMILES

C[C@@H](C(=O)NC1CCCCC1)OC(=O)CCNS(=O)(=O)C2=CC=CS2

InChI

InChI=1S/C16H24N2O5S2/c1-12(16(20)18-13-6-3-2-4-7-13)23-14(19)9-10-17-25(21,22)15-8-5-11-24-15/h5,8,11-13,17H,2-4,6-7,9-10H2,1H3,(H,18,20)/t12-/m0/s1