2-[(3-methyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]-N-[2-piperidin-1-yl-5-(trifluoromethyl)phenyl]ethanamide

Systemtic Name: 2-[(3-methyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]-N-[2-piperidin-1-yl-5-(trifluoromethyl)phenyl]ethanamide Openeye Name: 2-[(3-methyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]-N-[2-(1-piperidyl)-5-(trifluoromethyl)phenyl]acetamide CAS Name: 2-[(3-methyl-1H-benzimidazol-3-ium-2-yl)thio]-N-[2-(1-piperidinyl)-5-(trifluoromethyl)phenyl]acetamide IUPAC Name: 2-[(3-methyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]-N-[2-piperidin-1-yl-5-(trifluoromethyl)phenyl]acetamide Traditional Name: 2-[(3-methyl-1H-benzimidazol-3-ium-2-yl)thio]-N-[2-piperidino-5-(trifluoromethyl)phenyl]acetamide Formula: C22H24F3N4OS+ MolecularWeight: 449.51237

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(NC2=CC=CC=C21)SCC(=O)NC3=C(C=CC(=C3)C(F)(F)F)N4CCCCC4

Isomeric SMILES

C[N+]1=C(NC2=CC=CC=C21)SCC(=O)NC3=C(C=CC(=C3)C(F)(F)F)N4CCCCC4

InChI

InChI=1S/C22H23F3N4OS/c1-28-18-8-4-3-7-16(18)27-21(28)31-14-20(30)26-17-13-15(22(23,24)25)9-10-19(17)29-11-5-2-6-12-29/h3-4,7-10,13H,2,5-6,11-12,14H2,1H3,(H,26,30)/p+1