methyl 2-methyl-3-[(4-methylsulfanylphenyl)amino]propanoate

Systemtic Name: methyl 2-methyl-3-[(4-methylsulfanylphenyl)amino]propanoate Openeye Name: methyl 2-methyl-3-(4-methylsulfanylanilino)propanoate CAS Name: 2-methyl-3-[4-(methylthio)anilino]propanoic acid methyl ester IUPAC Name: methyl 2-methyl-3-(4-methylsulfanylanilino)propanoate Traditional Name: 2-methyl-3-[4-(methylthio)anilino]propionic acid methyl ester Formula: C12H17NO2S MolecularWeight: 239.33388

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC1=CC=C(C=C1)SC)C(=O)OC

Isomeric SMILES

CC(CNC1=CC=C(C=C1)SC)C(=O)OC

InChI

InChI=1S/C12H17NO2S/c1-9(12(14)15-2)8-13-10-4-6-11(16-3)7-5-10/h4-7,9,13H,8H2,1-3H3