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

Systemtic Name: N-[2-(4-dimethylaminophenyl)-2-pyrrolidin-1-yl-ethyl]-5-fluoranyl-2-methoxy-benzenesulfonamide Openeye Name: N-[2-(4-dimethylaminophenyl)-2-pyrrolidin-1-yl-ethyl]-5-fluoro-2-methoxy-benzenesulfonamide CAS Name: N-[2-(4-dimethylaminophenyl)-2-(1-pyrrolidinyl)ethyl]-5-fluoro-2-methoxybenzenesulfonamide IUPAC Name: N-[2-(4-dimethylaminophenyl)-2-pyrrolidin-1-ylethyl]-5-fluoro-2-methoxybenzenesulfonamide Traditional Name: N-[2-(4-dimethylaminophenyl)-2-pyrrolidino-ethyl]-5-fluoro-2-methoxy-benzenesulfonamide Formula: C21H28FN3O3S MolecularWeight: 421.528723

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)OC)N3CCCC3

Isomeric SMILES

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

InChI

InChI=1S/C21H28FN3O3S/c1-24(2)18-9-6-16(7-10-18)19(25-12-4-5-13-25)15-23-29(26,27)21-14-17(22)8-11-20(21)28-3/h6-11,14,19,23H,4-5,12-13,15H2,1-3H3