2-[2-(2-butoxy-2-oxidanylidene-ethyl)sulfanyl-4-methyl-1,3-thiazol-5-yl]ethanoic acid

Systemtic Name: 2-[2-(2-butoxy-2-oxidanylidene-ethyl)sulfanyl-4-methyl-1,3-thiazol-5-yl]ethanoic acid Openeye Name: 2-[2-(2-butoxy-2-oxo-ethyl)sulfanyl-4-methyl-thiazol-5-yl]acetic acid CAS Name: 2-[2-[(2-butoxy-2-oxoethyl)thio]-4-methyl-5-thiazolyl]acetic acid IUPAC Name: 2-[2-(2-butoxy-2-oxoethyl)sulfanyl-4-methyl-1,3-thiazol-5-yl]acetic acid Traditional Name: 2-[2-[(2-butoxy-2-keto-ethyl)thio]-4-methyl-thiazol-5-yl]acetic acid Formula: C12H17NO4S2 MolecularWeight: 303.39768

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)CSC1=NC(=C(S1)CC(=O)O)C

Isomeric SMILES

CCCCOC(=O)CSC1=NC(=C(S1)CC(=O)O)C

InChI

InChI=1S/C12H17NO4S2/c1-3-4-5-17-11(16)7-18-12-13-8(2)9(19-12)6-10(14)15/h3-7H2,1-2H3,(H,14,15)