4-[(5-ethyl-1,3,4-thiadiazol-2-yl)amino]-4-oxidanylidene-2-sulfo-butanoic acid

Systemtic Name: 4-[(5-ethyl-1,3,4-thiadiazol-2-yl)amino]-4-oxidanylidene-2-sulfo-butanoic acid Openeye Name: 4-[(5-ethyl-1,3,4-thiadiazol-2-yl)amino]-4-oxo-2-sulfo-butanoic acid CAS Name: 4-[(5-ethyl-1,3,4-thiadiazol-2-yl)amino]-4-oxo-2-sulfobutanoic acid IUPAC Name: 4-[(5-ethyl-1,3,4-thiadiazol-2-yl)amino]-4-oxo-2-sulfobutanoic acid Traditional Name: 4-[(5-ethyl-1,3,4-thiadiazol-2-yl)amino]-4-keto-2-sulfo-butyric acid Formula: C8H11N3O6S2 MolecularWeight: 309.31944

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(S1)NC(=O)CC(C(=O)O)S(=O)(=O)O

Isomeric SMILES

CCC1=NN=C(S1)NC(=O)CC(C(=O)O)S(=O)(=O)O

InChI

InChI=1S/C8H11N3O6S2/c1-2-6-10-11-8(18-6)9-5(12)3-4(7(13)14)19(15,16)17/h4H,2-3H2,1H3,(H,13,14)(H,9,11,12)(H,15,16,17)