N-[2-(diethylamino)-5-(trifluoromethyl)phenyl]-1-pyridin-3-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[2-(diethylamino)-5-(trifluoromethyl)phenyl]-1-pyridin-3-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[2-(diethylamino)-5-(trifluoromethyl)phenyl]-1-(3-pyridylsulfonyl)piperidine-4-carboxamide CAS Name: N-[2-(diethylamino)-5-(trifluoromethyl)phenyl]-1-(3-pyridinylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-[2-(diethylamino)-5-(trifluoromethyl)phenyl]-1-pyridin-3-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-[2-(diethylamino)-5-(trifluoromethyl)phenyl]-1-(3-pyridylsulfonyl)isonipecotamide Formula: C22H27F3N4O3S MolecularWeight: 484.53499

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=C(C=C(C=C1)C(F)(F)F)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CN=CC=C3

Isomeric SMILES

CCN(CC)C1=C(C=C(C=C1)C(F)(F)F)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CN=CC=C3

InChI

InChI=1S/C22H27F3N4O3S/c1-3-28(4-2)20-8-7-17(22(23,24)25)14-19(20)27-21(30)16-9-12-29(13-10-16)33(31,32)18-6-5-11-26-15-18/h5-8,11,14-16H,3-4,9-10,12-13H2,1-2H3,(H,27,30)