3-(4-methylsulfanylphenyl)sulfanylpropanoic acid

Systemtic Name: 3-(4-methylsulfanylphenyl)sulfanylpropanoic acid Openeye Name: 3-(4-methylsulfanylphenyl)sulfanylpropanoic acid CAS Name: 3-[[4-(methylthio)phenyl]thio]propanoic acid IUPAC Name: 3-(4-methylsulfanylphenyl)sulfanylpropanoic acid Traditional Name: 3-[[4-(methylthio)phenyl]thio]propionic acid Formula: C10H12O2S2 MolecularWeight: 228.33108

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)SCCC(=O)O

Isomeric SMILES

CSC1=CC=C(C=C1)SCCC(=O)O

InChI

InChI=1S/C10H12O2S2/c1-13-8-2-4-9(5-3-8)14-7-6-10(11)12/h2-5H,6-7H2,1H3,(H,11,12)