2-[(4-methylsulfanylphenyl)carbonylamino]propanoic acid

Systemtic Name: 2-[(4-methylsulfanylphenyl)carbonylamino]propanoic acid Openeye Name: 2-[(4-methylsulfanylbenzoyl)amino]propanoic acid CAS Name: 2-[[[4-(methylthio)phenyl]-oxomethyl]amino]propanoic acid IUPAC Name: 2-[(4-methylsulfanylbenzoyl)amino]propanoic acid Traditional Name: 2-[[4-(methylthio)benzoyl]amino]propionic acid Formula: C11H13NO3S MolecularWeight: 239.29082

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NC(=O)C1=CC=C(C=C1)SC

Isomeric SMILES

CC(C(=O)O)NC(=O)C1=CC=C(C=C1)SC

InChI

InChI=1S/C11H13NO3S/c1-7(11(14)15)12-10(13)8-3-5-9(16-2)6-4-8/h3-7H,1-2H3,(H,12,13)(H,14,15)