[2-oxidanylidene-2-(1-thiophen-2-ylethylamino)ethyl] 3-[(phenylmethyl)sulfamoyl]benzoate

Systemtic Name: [2-oxidanylidene-2-(1-thiophen-2-ylethylamino)ethyl] 3-[(phenylmethyl)sulfamoyl]benzoate Openeye Name: [2-oxo-2-[1-(2-thienyl)ethylamino]ethyl] 3-(benzylsulfamoyl)benzoate CAS Name: 3-[(phenylmethyl)sulfamoyl]benzoic acid [2-oxo-2-(1-thiophen-2-ylethylamino)ethyl] ester IUPAC Name: [2-oxo-2-(1-thiophen-2-ylethylamino)ethyl] 3-(benzylsulfamoyl)benzoate Traditional Name: 3-(benzylsulfamoyl)benzoic acid [2-keto-2-[1-(2-thienyl)ethylamino]ethyl] ester Formula: C22H22N2O5S2 MolecularWeight: 458.55048

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CS1)NC(=O)COC(=O)C2=CC(=CC=C2)S(=O)(=O)NCC3=CC=CC=C3

Isomeric SMILES

CC(C1=CC=CS1)NC(=O)COC(=O)C2=CC(=CC=C2)S(=O)(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C22H22N2O5S2/c1-16(20-11-6-12-30-20)24-21(25)15-29-22(26)18-9-5-10-19(13-18)31(27,28)23-14-17-7-3-2-4-8-17/h2-13,16,23H,14-15H2,1H3,(H,24,25)