5-acetamido-2-(2-methylsulfanylethanoylamino)benzoate

Systemtic Name: 5-acetamido-2-(2-methylsulfanylethanoylamino)benzoate Openeye Name: 5-acetamido-2-[(2-methylsulfanylacetyl)amino]benzoate CAS Name: 5-acetamido-2-[[2-(methylthio)-1-oxoethyl]amino]benzoate IUPAC Name: 5-acetamido-2-[(2-methylsulfanylacetyl)amino]benzoate Traditional Name: 5-acetamido-2-[[2-(methylthio)acetyl]amino]benzoate Formula: C12H13N2O4S- MolecularWeight: 281.30762

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1)NC(=O)CSC)C(=O)[O-]

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1)NC(=O)CSC)C(=O)[O-]

InChI

InChI=1S/C12H14N2O4S/c1-7(15)13-8-3-4-10(9(5-8)12(17)18)14-11(16)6-19-2/h3-5H,6H2,1-2H3,(H,13,15)(H,14,16)(H,17,18)/p-1