2-[2-(carboxymethylsulfanyl)-1,3-thiazol-4-yl]propanoic acid

Systemtic Name: 2-[2-(carboxymethylsulfanyl)-1,3-thiazol-4-yl]propanoic acid Openeye Name: 2-[2-(carboxymethylsulfanyl)thiazol-4-yl]propanoic acid CAS Name: 2-[2-(carboxymethylthio)-4-thiazolyl]propanoic acid IUPAC Name: 2-[2-(carboxymethylsulfanyl)-1,3-thiazol-4-yl]propanoic acid Traditional Name: 2-[2-(carboxymethylthio)thiazol-4-yl]propionic acid Formula: C8H9NO4S2 MolecularWeight: 247.29136

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CSC(=N1)SCC(=O)O)C(=O)O

Isomeric SMILES

CC(C1=CSC(=N1)SCC(=O)O)C(=O)O

InChI

InChI=1S/C8H9NO4S2/c1-4(7(12)13)5-2-14-8(9-5)15-3-6(10)11/h2,4H,3H2,1H3,(H,10,11)(H,12,13)