2-(2-azanyl-1,3-thiazol-4-yl)propanedioic acid

Systemtic Name: 2-(2-azanyl-1,3-thiazol-4-yl)propanedioic acid Openeye Name: 2-(2-aminothiazol-4-yl)propanedioic acid CAS Name: 2-(2-amino-4-thiazolyl)propanedioic acid IUPAC Name: 2-(2-amino-1,3-thiazol-4-yl)propanedioic acid Traditional Name: 2-(2-aminothiazol-4-yl)malonic acid Formula: C6H6N2O4S MolecularWeight: 202.18784

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(N=C(S1)N)C(C(=O)O)C(=O)O

Isomeric SMILES

C1=C(N=C(S1)N)C(C(=O)O)C(=O)O

InChI

InChI=1S/C6H6N2O4S/c7-6-8-2(1-13-6)3(4(9)10)5(11)12/h1,3H,(H2,7,8)(H,9,10)(H,11,12)