[(2S)-1-ethoxy-1-oxidanylidene-3-sulfanyl-propan-2-yl]azanium chloride

Systemtic Name: [(2S)-1-ethoxy-1-oxidanylidene-3-sulfanyl-propan-2-yl]azanium chloride Openeye Name: [(1S)-2-ethoxy-2-oxo-1-(sulfanylmethyl)ethyl]ammonium chloride CAS Name: [(2S)-1-ethoxy-3-mercapto-1-oxopropan-2-yl]ammonium chloride IUPAC Name: [(2S)-1-ethoxy-1-oxo-3-sulfanylpropan-2-yl]azanium chloride Traditional Name: [(1S)-2-ethoxy-2-keto-1-(mercaptomethyl)ethyl]ammonium chloride Formula: C5H12ClNO2S MolecularWeight: 185.67228

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CS)[NH3+].[Cl-]

Isomeric SMILES

CCOC(=O)[C@@H](CS)[NH3+].[Cl-]

InChI

InChI=1S/C5H11NO2S.ClH/c1-2-8-5(7)4(6)3-9;/h4,9H,2-3,6H2,1H3;1H/t4-;/m1./s1