N-(2-thiophen-2-ylethyl)-1-[3-(trifluoromethyl)phenyl]sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(2-thiophen-2-ylethyl)-1-[3-(trifluoromethyl)phenyl]sulfonyl-piperidine-4-carboxamide Openeye Name: N-[2-(2-thienyl)ethyl]-1-[3-(trifluoromethyl)phenyl]sulfonyl-piperidine-4-carboxamide CAS Name: N-(2-thiophen-2-ylethyl)-1-[3-(trifluoromethyl)phenyl]sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(2-thiophen-2-ylethyl)-1-[3-(trifluoromethyl)phenyl]sulfonylpiperidine-4-carboxamide Traditional Name: N-[2-(2-thienyl)ethyl]-1-[3-(trifluoromethyl)phenyl]sulfonyl-isonipecotamide Formula: C19H21F3N2O3S2 MolecularWeight: 446.50685

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCCC2=CC=CS2)S(=O)(=O)C3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

C1CN(CCC1C(=O)NCCC2=CC=CS2)S(=O)(=O)C3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C19H21F3N2O3S2/c20-19(21,22)15-3-1-5-17(13-15)29(26,27)24-10-7-14(8-11-24)18(25)23-9-6-16-4-2-12-28-16/h1-5,12-14H,6-11H2,(H,23,25)