3-[(3-thiophen-3-ylpropanoylamino)carbamoyl]-N-[3-(trifluoromethyl)phenyl]benzenesulfonamide

Systemtic Name: 3-[(3-thiophen-3-ylpropanoylamino)carbamoyl]-N-[3-(trifluoromethyl)phenyl]benzenesulfonamide Openeye Name: 3-[[3-(3-thienyl)propanoylamino]carbamoyl]-N-[3-(trifluoromethyl)phenyl]benzenesulfonamide CAS Name: 3-[oxo-[[1-oxo-3-(3-thiophenyl)propyl]hydrazo]methyl]-N-[3-(trifluoromethyl)phenyl]benzenesulfonamide IUPAC Name: 3-[(3-thiophen-3-ylpropanoylamino)carbamoyl]-N-[3-(trifluoromethyl)phenyl]benzenesulfonamide Traditional Name: 3-[[3-(3-thienyl)propanoylamino]carbamoyl]-N-[3-(trifluoromethyl)phenyl]benzenesulfonamide Formula: C21H18F3N3O4S2 MolecularWeight: 497.51053

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)(=O)NC2=CC=CC(=C2)C(F)(F)F)C(=O)NNC(=O)CCC3=CSC=C3

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)(=O)NC2=CC=CC(=C2)C(F)(F)F)C(=O)NNC(=O)CCC3=CSC=C3

InChI

InChI=1S/C21H18F3N3O4S2/c22-21(23,24)16-4-2-5-17(12-16)27-33(30,31)18-6-1-3-15(11-18)20(29)26-25-19(28)8-7-14-9-10-32-13-14/h1-6,9-13,27H,7-8H2,(H,25,28)(H,26,29)