5-ethoxy-5-oxidanylidene-2-(thiophen-2-ylsulfanylmethyl)pentanoic acid

Systemtic Name: 5-ethoxy-5-oxidanylidene-2-(thiophen-2-ylsulfanylmethyl)pentanoic acid Openeye Name: 5-ethoxy-5-oxo-2-(2-thienylsulfanylmethyl)pentanoic acid CAS Name: 5-ethoxy-5-oxo-2-[(thiophen-2-ylthio)methyl]pentanoic acid IUPAC Name: 5-ethoxy-5-oxo-2-(thiophen-2-ylsulfanylmethyl)pentanoic acid Traditional Name: 5-ethoxy-5-keto-2-[(2-thienylthio)methyl]valeric acid Formula: C12H16O4S2 MolecularWeight: 288.38304

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(CSC1=CC=CS1)C(=O)O

Isomeric SMILES

CCOC(=O)CCC(CSC1=CC=CS1)C(=O)O

InChI

InChI=1S/C12H16O4S2/c1-2-16-10(13)6-5-9(12(14)15)8-18-11-4-3-7-17-11/h3-4,7,9H,2,5-6,8H2,1H3,(H,14,15)