2-(2-azanyl-1,3-thiazol-4-yl)-2-sulfo-ethanoate

Systemtic Name: 2-(2-azanyl-1,3-thiazol-4-yl)-2-sulfo-ethanoate Openeye Name: 2-(2-aminothiazol-4-yl)-2-sulfo-acetate CAS Name: 2-(2-amino-4-thiazolyl)-2-sulfoacetate IUPAC Name: 2-(2-amino-1,3-thiazol-4-yl)-2-sulfoacetate Traditional Name: 2-(2-aminothiazol-4-yl)-2-sulfo-acetate Formula: C5H5N2O5S2- MolecularWeight: 237.2336

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(N=C(S1)N)C(C(=O)[O-])S(=O)(=O)O

Isomeric SMILES

C1=C(N=C(S1)N)C(C(=O)[O-])S(=O)(=O)O

InChI

InChI=1S/C5H6N2O5S2/c6-5-7-2(1-13-5)3(4(8)9)14(10,11)12/h1,3H,(H2,6,7)(H,8,9)(H,10,11,12)/p-1