dimethyl 5-(2-methylsulfanylethanoylamino)benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-(2-methylsulfanylethanoylamino)benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[(2-methylsulfanylacetyl)amino]benzene-1,3-dicarboxylate CAS Name: 5-[[2-(methylthio)-1-oxoethyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[(2-methylsulfanylacetyl)amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[2-(methylthio)acetyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C13H15NO5S MolecularWeight: 297.3269

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)NC(=O)CSC)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)NC(=O)CSC)C(=O)OC

InChI

InChI=1S/C13H15NO5S/c1-18-12(16)8-4-9(13(17)19-2)6-10(5-8)14-11(15)7-20-3/h4-6H,7H2,1-3H3,(H,14,15)