[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl] 3-[(4-fluorophenyl)sulfamoyl]benzoate

Systemtic Name: [2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl] 3-[(4-fluorophenyl)sulfamoyl]benzoate Openeye Name: [2-oxo-2-(2-thienylmethylamino)ethyl] 3-[(4-fluorophenyl)sulfamoyl]benzoate CAS Name: 3-[(4-fluorophenyl)sulfamoyl]benzoic acid [2-oxo-2-(thiophen-2-ylmethylamino)ethyl] ester IUPAC Name: [2-oxo-2-(thiophen-2-ylmethylamino)ethyl] 3-[(4-fluorophenyl)sulfamoyl]benzoate Traditional Name: 3-[(4-fluorophenyl)sulfamoyl]benzoic acid [2-keto-2-(2-thenylamino)ethyl] ester Formula: C20H17FN2O5S2 MolecularWeight: 448.487783

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)(=O)NC2=CC=C(C=C2)F)C(=O)OCC(=O)NCC3=CC=CS3

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)(=O)NC2=CC=C(C=C2)F)C(=O)OCC(=O)NCC3=CC=CS3

InChI

InChI=1S/C20H17FN2O5S2/c21-15-6-8-16(9-7-15)23-30(26,27)18-5-1-3-14(11-18)20(25)28-13-19(24)22-12-17-4-2-10-29-17/h1-11,23H,12-13H2,(H,22,24)