3-(2-azanyl-1,3-thiazol-3-ium-3-yl)-2,4-disulfonyl-pentanedioic acid

Systemtic Name: 3-(2-azanyl-1,3-thiazol-3-ium-3-yl)-2,4-disulfonyl-pentanedioic acid Openeye Name: 3-(2-aminothiazol-3-ium-3-yl)-2,4-disulfonyl-pentanedioic acid CAS Name: 3-(2-amino-3-thiazol-3-iumyl)-2,4-disulfonylpentanedioic acid IUPAC Name: 3-(2-amino-1,3-thiazol-3-ium-3-yl)-2,4-disulfonylpentanedioic acid Traditional Name: 3-(2-aminothiazol-3-ium-3-yl)-2,4-disulfonyl-glutaric acid Formula: C8H7N2O8S3+ MolecularWeight: 355.34478

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=[N+]1C(C(=S(=O)=O)C(=O)O)C(=S(=O)=O)C(=O)O)N

Isomeric SMILES

C1=CSC(=[N+]1C(C(=S(=O)=O)C(=O)O)C(=S(=O)=O)C(=O)O)N

InChI

InChI=1S/C8H6N2O8S3/c9-8-10(1-2-19-8)3(4(6(11)12)20(15)16)5(7(13)14)21(17)18/h1-3,9H,(H2,11,12,13,14)/p+1