4-[[5-(carboxymethyl)-1,3-thiazol-2-yl]sulfanyl]butanoic acid

Systemtic Name: 4-[[5-(carboxymethyl)-1,3-thiazol-2-yl]sulfanyl]butanoic acid Openeye Name: 4-[5-(carboxymethyl)thiazol-2-yl]sulfanylbutanoic acid CAS Name: 4-[[5-(carboxymethyl)-2-thiazolyl]thio]butanoic acid IUPAC Name: 4-[[5-(carboxymethyl)-1,3-thiazol-2-yl]sulfanyl]butanoic acid Traditional Name: 4-[[5-(carboxymethyl)thiazol-2-yl]thio]butyric acid Formula: C9H11NO4S2 MolecularWeight: 261.31794

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(SC(=N1)SCCCC(=O)O)CC(=O)O

Isomeric SMILES

C1=C(SC(=N1)SCCCC(=O)O)CC(=O)O

InChI

InChI=1S/C9H11NO4S2/c11-7(12)2-1-3-15-9-10-5-6(16-9)4-8(13)14/h5H,1-4H2,(H,11,12)(H,13,14)