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

Systemtic Name: N-(1,3-thiazol-2-yl)-1-[3-(trifluoromethyl)phenyl]sulfonyl-piperidine-4-carboxamide Openeye Name: N-thiazol-2-yl-1-[3-(trifluoromethyl)phenyl]sulfonyl-piperidine-4-carboxamide CAS Name: N-(2-thiazolyl)-1-[3-(trifluoromethyl)phenyl]sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(1,3-thiazol-2-yl)-1-[3-(trifluoromethyl)phenyl]sulfonylpiperidine-4-carboxamide Traditional Name: N-thiazol-2-yl-1-[3-(trifluoromethyl)phenyl]sulfonyl-isonipecotamide Formula: C16H16F3N3O3S2 MolecularWeight: 419.44175

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=NC=CS2)S(=O)(=O)C3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

C1CN(CCC1C(=O)NC2=NC=CS2)S(=O)(=O)C3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C16H16F3N3O3S2/c17-16(18,19)12-2-1-3-13(10-12)27(24,25)22-7-4-11(5-8-22)14(23)21-15-20-6-9-26-15/h1-3,6,9-11H,4-5,7-8H2,(H,20,21,23)