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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)N1C(=CSC1=S)CC(=O)O

Isomeric SMILES

CC(C(=O)O)N1C(=CSC1=S)CC(=O)O

InChI

InChI=1S/C8H9NO4S2/c1-4(7(12)13)9-5(2-6(10)11)3-15-8(9)14/h3-4H,2H2,1H3,(H,10,11)(H,12,13)