N-[4-fluoranyl-3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]-1-(phenylsulfonyl)piperidine-4-carboxamide

Systemtic Name: N-[4-fluoranyl-3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]-1-(phenylsulfonyl)piperidine-4-carboxamide Openeye Name: 1-(benzenesulfonyl)-N-[4-fluoro-3-(2-oxopyrrolidin-1-yl)phenyl]piperidine-4-carboxamide CAS Name: 1-(benzenesulfonyl)-N-[4-fluoro-3-(2-oxo-1-pyrrolidinyl)phenyl]-4-piperidinecarboxamide IUPAC Name: 1-(benzenesulfonyl)-N-[4-fluoro-3-(2-oxopyrrolidin-1-yl)phenyl]piperidine-4-carboxamide Traditional Name: 1-besyl-N-[4-fluoro-3-(2-ketopyrrolidino)phenyl]isonipecotamide Formula: C22H24FN3O4S MolecularWeight: 445.507063

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=C(C=CC(=C2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CC=C4)F

Isomeric SMILES

C1CC(=O)N(C1)C2=C(C=CC(=C2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CC=C4)F

InChI

InChI=1S/C22H24FN3O4S/c23-19-9-8-17(15-20(19)26-12-4-7-21(26)27)24-22(28)16-10-13-25(14-11-16)31(29,30)18-5-2-1-3-6-18/h1-3,5-6,8-9,15-16H,4,7,10-14H2,(H,24,28)