3-methyl-3-thiophen-2-ylsulfanyl-butanoic acid

Systemtic Name: 3-methyl-3-thiophen-2-ylsulfanyl-butanoic acid Openeye Name: 3-methyl-3-(2-thienylsulfanyl)butanoic acid CAS Name: 3-methyl-3-(thiophen-2-ylthio)butanoic acid IUPAC Name: 3-methyl-3-thiophen-2-ylsulfanylbutanoic acid Traditional Name: 3-methyl-3-(2-thienylthio)butyric acid Formula: C9H12O2S2 MolecularWeight: 216.32038

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(=O)O)SC1=CC=CS1

Isomeric SMILES

CC(C)(CC(=O)O)SC1=CC=CS1

InChI

InChI=1S/C9H12O2S2/c1-9(2,6-7(10)11)13-8-4-3-5-12-8/h3-5H,6H2,1-2H3,(H,10,11)