N-(5-methyl-1,2-oxazol-3-yl)-1-[3-(trifluoromethyloxy)phenyl]sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(5-methyl-1,2-oxazol-3-yl)-1-[3-(trifluoromethyloxy)phenyl]sulfonyl-piperidine-4-carboxamide Openeye Name: N-(5-methylisoxazol-3-yl)-1-[3-(trifluoromethoxy)phenyl]sulfonyl-piperidine-4-carboxamide CAS Name: N-(5-methyl-3-isoxazolyl)-1-[3-(trifluoromethoxy)phenyl]sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(5-methyl-1,2-oxazol-3-yl)-1-[3-(trifluoromethoxy)phenyl]sulfonylpiperidine-4-carboxamide Traditional Name: N-(5-methylisoxazol-3-yl)-1-[3-(trifluoromethoxy)phenyl]sulfonyl-isonipecotamide Formula: C17H18F3N3O5S MolecularWeight: 433.40213

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)OC(F)(F)F

Isomeric SMILES

CC1=CC(=NO1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)OC(F)(F)F

InChI

InChI=1S/C17H18F3N3O5S/c1-11-9-15(22-28-11)21-16(24)12-5-7-23(8-6-12)29(25,26)14-4-2-3-13(10-14)27-17(18,19)20/h2-4,9-10,12H,5-8H2,1H3,(H,21,22,24)