4-pyrrolidin-1-ylsulfonyl-N-[2-[2,2,2-tris(fluoranyl)ethylsulfanyl]phenyl]benzenesulfonamide

Systemtic Name: 4-pyrrolidin-1-ylsulfonyl-N-[2-[2,2,2-tris(fluoranyl)ethylsulfanyl]phenyl]benzenesulfonamide Openeye Name: 4-pyrrolidin-1-ylsulfonyl-N-[2-(2,2,2-trifluoroethylsulfanyl)phenyl]benzenesulfonamide CAS Name: 4-(1-pyrrolidinylsulfonyl)-N-[2-(2,2,2-trifluoroethylthio)phenyl]benzenesulfonamide IUPAC Name: 4-pyrrolidin-1-ylsulfonyl-N-[2-(2,2,2-trifluoroethylsulfanyl)phenyl]benzenesulfonamide Traditional Name: 4-pyrrolidinosulfonyl-N-[2-(2,2,2-trifluoroethylthio)phenyl]benzenesulfonamide Formula: C18H19F3N2O4S3 MolecularWeight: 480.54467

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)NC3=CC=CC=C3SCC(F)(F)F

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)NC3=CC=CC=C3SCC(F)(F)F

InChI

InChI=1S/C18H19F3N2O4S3/c19-18(20,21)13-28-17-6-2-1-5-16(17)22-29(24,25)14-7-9-15(10-8-14)30(26,27)23-11-3-4-12-23/h1-2,5-10,22H,3-4,11-13H2