2-[[5-(2-morpholin-4-ium-4-ylethanoylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanoate

Systemtic Name: 2-[[5-(2-morpholin-4-ium-4-ylethanoylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanoate Openeye Name: 2-[[5-[(2-morpholin-4-ium-4-ylacetyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]acetate CAS Name: 2-[[5-[[2-(4-morpholin-4-iumyl)-1-oxoethyl]amino]-1,3,4-thiadiazol-2-yl]thio]acetate IUPAC Name: 2-[[5-[(2-morpholin-4-ium-4-ylacetyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]acetate Traditional Name: 2-[[5-[(2-morpholin-4-ium-4-ylacetyl)amino]-1,3,4-thiadiazol-2-yl]thio]acetate Formula: C10H14N4O4S2 MolecularWeight: 318.37256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC(=O)NC2=NN=C(S2)SCC(=O)[O-]

Isomeric SMILES

C1COCC[NH+]1CC(=O)NC2=NN=C(S2)SCC(=O)[O-]

InChI

InChI=1S/C10H14N4O4S2/c15-7(5-14-1-3-18-4-2-14)11-9-12-13-10(20-9)19-6-8(16)17/h1-6H2,(H,16,17)(H,11,12,15)