N-[2-(4-dimethylaminophenyl)-2-pyrrolidin-1-yl-ethyl]-1-(4-fluorophenyl)methanesulfonamide

Systemtic Name: N-[2-(4-dimethylaminophenyl)-2-pyrrolidin-1-yl-ethyl]-1-(4-fluorophenyl)methanesulfonamide Openeye Name: N-[2-(4-dimethylaminophenyl)-2-pyrrolidin-1-yl-ethyl]-1-(4-fluorophenyl)methanesulfonamide CAS Name: N-[2-(4-dimethylaminophenyl)-2-(1-pyrrolidinyl)ethyl]-1-(4-fluorophenyl)methanesulfonamide IUPAC Name: N-[2-(4-dimethylaminophenyl)-2-pyrrolidin-1-ylethyl]-1-(4-fluorophenyl)methanesulfonamide Traditional Name: N-[2-(4-dimethylaminophenyl)-2-pyrrolidino-ethyl]-1-(4-fluorophenyl)methanesulfonamide Formula: C21H28FN3O2S MolecularWeight: 405.529323

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C(CNS(=O)(=O)CC2=CC=C(C=C2)F)N3CCCC3

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C(CNS(=O)(=O)CC2=CC=C(C=C2)F)N3CCCC3

InChI

InChI=1S/C21H28FN3O2S/c1-24(2)20-11-7-18(8-12-20)21(25-13-3-4-14-25)15-23-28(26,27)16-17-5-9-19(22)10-6-17/h5-12,21,23H,3-4,13-16H2,1-2H3