N-(1-azabicyclo[2.2.2]octan-3-yl)-4-[[5-(trifluoromethyl)-1H-pyrrol-2-yl]sulfanyl]benzamide

Systemtic Name: N-(1-azabicyclo[2.2.2]octan-3-yl)-4-[[5-(trifluoromethyl)-1H-pyrrol-2-yl]sulfanyl]benzamide Openeye Name: N-quinuclidin-3-yl-4-[[5-(trifluoromethyl)-1H-pyrrol-2-yl]sulfanyl]benzamide CAS Name: N-(1-azabicyclo[2.2.2]octan-3-yl)-4-[[5-(trifluoromethyl)-1H-pyrrol-2-yl]thio]benzamide IUPAC Name: N-(1-azabicyclo[2.2.2]octan-3-yl)-4-[[5-(trifluoromethyl)-1H-pyrrol-2-yl]sulfanyl]benzamide Traditional Name: N-quinuclidin-3-yl-4-[[5-(trifluoromethyl)-1H-pyrrol-2-yl]thio]benzamide Formula: C19H20F3N3OS MolecularWeight: 395.44181

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2CCC1C(C2)NC(=O)C3=CC=C(C=C3)SC4=CC=C(N4)C(F)(F)F

Isomeric SMILES

C1CN2CCC1C(C2)NC(=O)C3=CC=C(C=C3)SC4=CC=C(N4)C(F)(F)F

InChI

InChI=1S/C19H20F3N3OS/c20-19(21,22)16-5-6-17(24-16)27-14-3-1-13(2-4-14)18(26)23-15-11-25-9-7-12(15)8-10-25/h1-6,12,15,24H,7-11H2,(H,23,26)