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

Systemtic Name: 4-[4-methyl-5-(2-methylsulfonyloxyethyl)-2-sulfanylidene-1,3-thiazol-3-yl]butanoic acid Openeye Name: 4-[4-methyl-5-(2-methylsulfonyloxyethyl)-2-thioxo-thiazol-3-yl]butanoic acid CAS Name: 4-[4-methyl-5-(2-methylsulfonyloxyethyl)-2-sulfanylidene-3-thiazolyl]butanoic acid IUPAC Name: 4-[4-methyl-5-(2-methylsulfonyloxyethyl)-2-sulfanylidene-1,3-thiazol-3-yl]butanoic acid Traditional Name: 4-[4-methyl-5-(2-methylsulfonyloxyethyl)-2-thioxo-4-thiazolin-3-yl]butyric acid Formula: C11H17NO5S3 MolecularWeight: 339.45138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=S)N1CCCC(=O)O)CCOS(=O)(=O)C

Isomeric SMILES

CC1=C(SC(=S)N1CCCC(=O)O)CCOS(=O)(=O)C

InChI

InChI=1S/C11H17NO5S3/c1-8-9(5-7-17-20(2,15)16)19-11(18)12(8)6-3-4-10(13)14/h3-7H2,1-2H3,(H,13,14)