2-[(2-methylsulfanylphenyl)amino]butanoic acid

Systemtic Name: 2-[(2-methylsulfanylphenyl)amino]butanoic acid Openeye Name: 2-(2-methylsulfanylanilino)butanoic acid CAS Name: 2-[2-(methylthio)anilino]butanoic acid IUPAC Name: 2-(2-methylsulfanylanilino)butanoic acid Traditional Name: 2-[2-(methylthio)anilino]butyric acid Formula: C11H15NO2S MolecularWeight: 225.3073

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)NC1=CC=CC=C1SC

Isomeric SMILES

CCC(C(=O)O)NC1=CC=CC=C1SC

InChI

InChI=1S/C11H15NO2S/c1-3-8(11(13)14)12-9-6-4-5-7-10(9)15-2/h4-8,12H,3H2,1-2H3,(H,13,14)