5-[1-(4-methyl-1,3-thiazol-5-yl)-2-oxidanyl-2-oxidanylidene-ethyl]sulfanylpentanoic acid

Systemtic Name: 5-[1-(4-methyl-1,3-thiazol-5-yl)-2-oxidanyl-2-oxidanylidene-ethyl]sulfanylpentanoic acid Openeye Name: 5-[2-hydroxy-1-(4-methylthiazol-5-yl)-2-oxo-ethyl]sulfanylpentanoic acid CAS Name: 5-[[2-hydroxy-1-(4-methyl-5-thiazolyl)-2-oxoethyl]thio]pentanoic acid IUPAC Name: 5-[2-hydroxy-1-(4-methyl-1,3-thiazol-5-yl)-2-oxoethyl]sulfanylpentanoic acid Traditional Name: 5-[[2-hydroxy-2-keto-1-(4-methylthiazol-5-yl)ethyl]thio]valeric acid Formula: C11H15NO4S2 MolecularWeight: 289.3711

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=N1)C(C(=O)O)SCCCCC(=O)O

Isomeric SMILES

CC1=C(SC=N1)C(C(=O)O)SCCCCC(=O)O

InChI

InChI=1S/C11H15NO4S2/c1-7-9(18-6-12-7)10(11(15)16)17-5-3-2-4-8(13)14/h6,10H,2-5H2,1H3,(H,13,14)(H,15,16)