2-[(4-carboxy-1,3-thiazol-2-yl)methyl]-1,3-thiazole-4-carboxylic acid

Systemtic Name: 2-[(4-carboxy-1,3-thiazol-2-yl)methyl]-1,3-thiazole-4-carboxylic acid Openeye Name: 2-[(4-carboxythiazol-2-yl)methyl]thiazole-4-carboxylic acid CAS Name: 2-[(4-carboxy-2-thiazolyl)methyl]-4-thiazolecarboxylic acid IUPAC Name: 2-[(4-carboxy-1,3-thiazol-2-yl)methyl]-1,3-thiazole-4-carboxylic acid Traditional Name: 2-[(4-carboxythiazol-2-yl)methyl]thiazole-4-carboxylic acid Formula: C9H6N2O4S2 MolecularWeight: 270.28494

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(N=C(S1)CC2=NC(=CS2)C(=O)O)C(=O)O

Isomeric SMILES

C1=C(N=C(S1)CC2=NC(=CS2)C(=O)O)C(=O)O

InChI

InChI=1S/C9H6N2O4S2/c12-8(13)4-2-16-6(10-4)1-7-11-5(3-17-7)9(14)15/h2-3H,1H2,(H,12,13)(H,14,15)