N-(1-azabicyclo[2.2.2]octan-3-yl)-4-(3-ethanoylphenyl)sulfanyl-benzamide

Systemtic Name: N-(1-azabicyclo[2.2.2]octan-3-yl)-4-(3-ethanoylphenyl)sulfanyl-benzamide Openeye Name: 4-(3-acetylphenyl)sulfanyl-N-quinuclidin-3-yl-benzamide CAS Name: 4-[(3-acetylphenyl)thio]-N-(1-azabicyclo[2.2.2]octan-3-yl)benzamide IUPAC Name: 4-(3-acetylphenyl)sulfanyl-N-(1-azabicyclo[2.2.2]octan-3-yl)benzamide Traditional Name: 4-[(3-acetylphenyl)thio]-N-quinuclidin-3-yl-benzamide Formula: C22H24N2O2S MolecularWeight: 380.50316

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)SC2=CC=C(C=C2)C(=O)NC3CN4CCC3CC4

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)SC2=CC=C(C=C2)C(=O)NC3CN4CCC3CC4

InChI

InChI=1S/C22H24N2O2S/c1-15(25)18-3-2-4-20(13-18)27-19-7-5-17(6-8-19)22(26)23-21-14-24-11-9-16(21)10-12-24/h2-8,13,16,21H,9-12,14H2,1H3,(H,23,26)