methyl 4-methyl-3-[2-[2-(thiophen-2-ylcarbonylamino)ethanoyloxy]ethanoylamino]benzoate

Systemtic Name: methyl 4-methyl-3-[2-[2-(thiophen-2-ylcarbonylamino)ethanoyloxy]ethanoylamino]benzoate Openeye Name: methyl 4-methyl-3-[[2-[2-(thiophene-2-carbonylamino)acetyl]oxyacetyl]amino]benzoate CAS Name: 4-methyl-3-[[1-oxo-2-[1-oxo-2-[[oxo(thiophen-2-yl)methyl]amino]ethoxy]ethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-methyl-3-[[2-[2-(thiophene-2-carbonylamino)acetyl]oxyacetyl]amino]benzoate Traditional Name: 4-methyl-3-[[2-[2-(2-thenoylamino)acetyl]oxyacetyl]amino]benzoic acid methyl ester Formula: C18H18N2O6S MolecularWeight: 390.41032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)COC(=O)CNC(=O)C2=CC=CS2

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)COC(=O)CNC(=O)C2=CC=CS2

InChI

InChI=1S/C18H18N2O6S/c1-11-5-6-12(18(24)25-2)8-13(11)20-15(21)10-26-16(22)9-19-17(23)14-4-3-7-27-14/h3-8H,9-10H2,1-2H3,(H,19,23)(H,20,21)