3-chloranyl-4-fluoranyl-N-[4-[(2-phenylethanoylamino)carbamoyl]phenyl]benzenesulfonamide

Systemtic Name: 3-chloranyl-4-fluoranyl-N-[4-[(2-phenylethanoylamino)carbamoyl]phenyl]benzenesulfonamide Openeye Name: 3-chloro-4-fluoro-N-[4-[[(2-phenylacetyl)amino]carbamoyl]phenyl]benzenesulfonamide CAS Name: 3-chloro-4-fluoro-N-[4-[oxo-[(1-oxo-2-phenylethyl)hydrazo]methyl]phenyl]benzenesulfonamide IUPAC Name: 3-chloro-4-fluoro-N-[4-[[(2-phenylacetyl)amino]carbamoyl]phenyl]benzenesulfonamide Traditional Name: 3-chloro-4-fluoro-N-[4-[[(2-phenylacetyl)amino]carbamoyl]phenyl]benzenesulfonamide Formula: C21H17ClFN3O4S MolecularWeight: 461.893783

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(=O)NNC(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC(=C(C=C3)F)Cl

Isomeric SMILES

C1=CC=C(C=C1)CC(=O)NNC(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C21H17ClFN3O4S/c22-18-13-17(10-11-19(18)23)31(29,30)26-16-8-6-15(7-9-16)21(28)25-24-20(27)12-14-4-2-1-3-5-14/h1-11,13,26H,12H2,(H,24,27)(H,25,28)