N-[2-(4-dimethylaminophenyl)-2-pyrrolidin-1-yl-ethyl]-2,5-bis(fluoranyl)benzenesulfonamide

Systemtic Name: N-[2-(4-dimethylaminophenyl)-2-pyrrolidin-1-yl-ethyl]-2,5-bis(fluoranyl)benzenesulfonamide Openeye Name: N-[2-(4-dimethylaminophenyl)-2-pyrrolidin-1-yl-ethyl]-2,5-difluoro-benzenesulfonamide CAS Name: N-[2-(4-dimethylaminophenyl)-2-(1-pyrrolidinyl)ethyl]-2,5-difluorobenzenesulfonamide IUPAC Name: N-[2-(4-dimethylaminophenyl)-2-pyrrolidin-1-ylethyl]-2,5-difluorobenzenesulfonamide Traditional Name: N-[2-(4-dimethylaminophenyl)-2-pyrrolidino-ethyl]-2,5-difluoro-benzenesulfonamide Formula: C20H25F2N3O2S MolecularWeight: 409.493206

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C(CNS(=O)(=O)C2=C(C=CC(=C2)F)F)N3CCCC3

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C(CNS(=O)(=O)C2=C(C=CC(=C2)F)F)N3CCCC3

InChI

InChI=1S/C20H25F2N3O2S/c1-24(2)17-8-5-15(6-9-17)19(25-11-3-4-12-25)14-23-28(26,27)20-13-16(21)7-10-18(20)22/h5-10,13,19,23H,3-4,11-12,14H2,1-2H3