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

Systemtic Name: N-(pyridin-3-ylmethyl)-1-[3-(trifluoromethyl)phenyl]sulfonyl-piperidine-4-carboxamide Openeye Name: N-(3-pyridylmethyl)-1-[3-(trifluoromethyl)phenyl]sulfonyl-piperidine-4-carboxamide CAS Name: N-(3-pyridinylmethyl)-1-[3-(trifluoromethyl)phenyl]sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(pyridin-3-ylmethyl)-1-[3-(trifluoromethyl)phenyl]sulfonylpiperidine-4-carboxamide Traditional Name: N-(3-pyridylmethyl)-1-[3-(trifluoromethyl)phenyl]sulfonyl-isonipecotamide Formula: C19H20F3N3O3S MolecularWeight: 427.44061

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCC2=CN=CC=C2)S(=O)(=O)C3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

C1CN(CCC1C(=O)NCC2=CN=CC=C2)S(=O)(=O)C3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C19H20F3N3O3S/c20-19(21,22)16-4-1-5-17(11-16)29(27,28)25-9-6-15(7-10-25)18(26)24-13-14-3-2-8-23-12-14/h1-5,8,11-12,15H,6-7,9-10,13H2,(H,24,26)