N-methyl-1-(pyridin-3-ylmethyl)-4-[4-[4-(trifluoromethyl)phenoxy]phenyl]sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-methyl-1-(pyridin-3-ylmethyl)-4-[4-[4-(trifluoromethyl)phenoxy]phenyl]sulfonyl-piperidine-4-carboxamide Openeye Name: N-methyl-1-(3-pyridylmethyl)-4-[4-[4-(trifluoromethyl)phenoxy]phenyl]sulfonyl-piperidine-4-carboxamide CAS Name: N-methyl-1-(3-pyridinylmethyl)-4-[4-[4-(trifluoromethyl)phenoxy]phenyl]sulfonyl-4-piperidinecarboxamide IUPAC Name: N-methyl-1-(pyridin-3-ylmethyl)-4-[4-[4-(trifluoromethyl)phenoxy]phenyl]sulfonylpiperidine-4-carboxamide Traditional Name: N-methyl-1-(3-pyridylmethyl)-4-[4-[4-(trifluoromethyl)phenoxy]phenyl]sulfonyl-isonipecotamide Formula: C26H26F3N3O4S MolecularWeight: 533.56255

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1(CCN(CC1)CC2=CN=CC=C2)S(=O)(=O)C3=CC=C(C=C3)OC4=CC=C(C=C4)C(F)(F)F

Isomeric SMILES

CNC(=O)C1(CCN(CC1)CC2=CN=CC=C2)S(=O)(=O)C3=CC=C(C=C3)OC4=CC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C26H26F3N3O4S/c1-30-24(33)25(12-15-32(16-13-25)18-19-3-2-14-31-17-19)37(34,35)23-10-8-22(9-11-23)36-21-6-4-20(5-7-21)26(27,28)29/h2-11,14,17H,12-13,15-16,18H2,1H3,(H,30,33)