N-[2-(phenylmethyl)pyrazol-3-yl]-1-[3-(trifluoromethyl)phenyl]sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[2-(phenylmethyl)pyrazol-3-yl]-1-[3-(trifluoromethyl)phenyl]sulfonyl-piperidine-4-carboxamide Openeye Name: N-(2-benzylpyrazol-3-yl)-1-[3-(trifluoromethyl)phenyl]sulfonyl-piperidine-4-carboxamide CAS Name: N-[2-(phenylmethyl)-3-pyrazolyl]-1-[3-(trifluoromethyl)phenyl]sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(2-benzylpyrazol-3-yl)-1-[3-(trifluoromethyl)phenyl]sulfonylpiperidine-4-carboxamide Traditional Name: N-(2-benzylpyrazol-3-yl)-1-[3-(trifluoromethyl)phenyl]sulfonyl-isonipecotamide Formula: C23H23F3N4O3S MolecularWeight: 492.51393

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC=NN2CC3=CC=CC=C3)S(=O)(=O)C4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC=NN2CC3=CC=CC=C3)S(=O)(=O)C4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C23H23F3N4O3S/c24-23(25,26)19-7-4-8-20(15-19)34(32,33)29-13-10-18(11-14-29)22(31)28-21-9-12-27-30(21)16-17-5-2-1-3-6-17/h1-9,12,15,18H,10-11,13-14,16H2,(H,28,31)