2-[2-[1,1-bis(oxidanylidene)thiolan-3-yl]sulfanylethanoylamino]propanoic acid

Systemtic Name: 2-[2-[1,1-bis(oxidanylidene)thiolan-3-yl]sulfanylethanoylamino]propanoic acid Openeye Name: 2-[[2-(1,1-dioxothiolan-3-yl)sulfanylacetyl]amino]propanoic acid CAS Name: 2-[[2-[(1,1-dioxo-3-thiolanyl)thio]-1-oxoethyl]amino]propanoic acid IUPAC Name: 2-[[2-(1,1-dioxothiolan-3-yl)sulfanylacetyl]amino]propanoic acid Traditional Name: 2-[[2-[(1,1-diketothiolan-3-yl)thio]acetyl]amino]propionic acid Formula: C9H15NO5S2 MolecularWeight: 281.3491

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NC(=O)CSC1CCS(=O)(=O)C1

Isomeric SMILES

CC(C(=O)O)NC(=O)CSC1CCS(=O)(=O)C1

InChI

InChI=1S/C9H15NO5S2/c1-6(9(12)13)10-8(11)4-16-7-2-3-17(14,15)5-7/h6-7H,2-5H2,1H3,(H,10,11)(H,12,13)