N-(1-pyridin-3-ylethyl)-1-[3-(trifluoromethyloxy)phenyl]sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(1-pyridin-3-ylethyl)-1-[3-(trifluoromethyloxy)phenyl]sulfonyl-piperidine-4-carboxamide Openeye Name: N-[1-(3-pyridyl)ethyl]-1-[3-(trifluoromethoxy)phenyl]sulfonyl-piperidine-4-carboxamide CAS Name: N-[1-(3-pyridinyl)ethyl]-1-[3-(trifluoromethoxy)phenyl]sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(1-pyridin-3-ylethyl)-1-[3-(trifluoromethoxy)phenyl]sulfonylpiperidine-4-carboxamide Traditional Name: N-[1-(3-pyridyl)ethyl]-1-[3-(trifluoromethoxy)phenyl]sulfonyl-isonipecotamide Formula: C20H22F3N3O4S MolecularWeight: 457.46659

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22F3N3O4S/c1-14(16-4-3-9-24-13-16)25-19(27)15-7-10-26(11-8-15)31(28,29)18-6-2-5-17(12-18)30-20(21,22)23/h2-6,9,12-15H,7-8,10-11H2,1H3,(H,25,27)