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

Systemtic Name: 4-[[5-(carboxymethyl)-4-methyl-1,3-thiazol-2-yl]sulfanyl]butanoic acid Openeye Name: 4-[5-(carboxymethyl)-4-methyl-thiazol-2-yl]sulfanylbutanoic acid CAS Name: 4-[[5-(carboxymethyl)-4-methyl-2-thiazolyl]thio]butanoic acid IUPAC Name: 4-[[5-(carboxymethyl)-4-methyl-1,3-thiazol-2-yl]sulfanyl]butanoic acid Traditional Name: 4-[[5-(carboxymethyl)-4-methyl-thiazol-2-yl]thio]butyric acid Formula: C20H26N2O8S4 MolecularWeight: 550.68904

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)SCCCC(=O)O)CC(=O)O.CC1=C(SC(=N1)SCCCC(=O)O)CC(=O)O

Isomeric SMILES

CC1=C(SC(=N1)SCCCC(=O)O)CC(=O)O.CC1=C(SC(=N1)SCCCC(=O)O)CC(=O)O

InChI

InChI=1S/2C10H13NO4S2/c2*1-6-7(5-9(14)15)17-10(11-6)16-4-2-3-8(12)13/h2*2-5H2,1H3,(H,12,13)(H,14,15)