methyl 3-(4-chlorophenyl)-3-[[3-(thiophen-2-ylmethylsulfamoyl)phenyl]carbonylamino]propanoate

Systemtic Name: methyl 3-(4-chlorophenyl)-3-[[3-(thiophen-2-ylmethylsulfamoyl)phenyl]carbonylamino]propanoate Openeye Name: methyl 3-(4-chlorophenyl)-3-[[3-(2-thienylmethylsulfamoyl)benzoyl]amino]propanoate CAS Name: 3-(4-chlorophenyl)-3-[[oxo-[3-(thiophen-2-ylmethylsulfamoyl)phenyl]methyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-(4-chlorophenyl)-3-[[3-(thiophen-2-ylmethylsulfamoyl)benzoyl]amino]propanoate Traditional Name: 3-(4-chlorophenyl)-3-[[3-(2-thenylsulfamoyl)benzoyl]amino]propionic acid methyl ester Formula: C22H21ClN2O5S2 MolecularWeight: 492.99554

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C1=CC=C(C=C1)Cl)NC(=O)C2=CC(=CC=C2)S(=O)(=O)NCC3=CC=CS3

Isomeric SMILES

COC(=O)CC(C1=CC=C(C=C1)Cl)NC(=O)C2=CC(=CC=C2)S(=O)(=O)NCC3=CC=CS3

InChI

InChI=1S/C22H21ClN2O5S2/c1-30-21(26)13-20(15-7-9-17(23)10-8-15)25-22(27)16-4-2-6-19(12-16)32(28,29)24-14-18-5-3-11-31-18/h2-12,20,24H,13-14H2,1H3,(H,25,27)