2-[2-(4-methylsulfanylphenyl)sulfanylethylamino]ethanoic acid

Systemtic Name: 2-[2-(4-methylsulfanylphenyl)sulfanylethylamino]ethanoic acid Openeye Name: 2-[2-(4-methylsulfanylphenyl)sulfanylethylamino]acetic acid CAS Name: 2-[2-[[4-(methylthio)phenyl]thio]ethylamino]acetic acid IUPAC Name: 2-[2-(4-methylsulfanylphenyl)sulfanylethylamino]acetic acid Traditional Name: 2-[2-[[4-(methylthio)phenyl]thio]ethylamino]acetic acid Formula: C11H15NO2S2 MolecularWeight: 257.3723

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H15NO2S2/c1-15-9-2-4-10(5-3-9)16-7-6-12-8-11(13)14/h2-5,12H,6-8H2,1H3,(H,13,14)