4-(2-ethanoylpyridin-4-yl)sulfanyl-N-(2-methyl-1-azabicyclo[2.2.2]octan-3-yl)benzamide

Systemtic Name: 4-(2-ethanoylpyridin-4-yl)sulfanyl-N-(2-methyl-1-azabicyclo[2.2.2]octan-3-yl)benzamide Openeye Name: 4-[(2-acetyl-4-pyridyl)sulfanyl]-N-(2-methylquinuclidin-3-yl)benzamide CAS Name: 4-[(2-acetyl-4-pyridinyl)thio]-N-(2-methyl-1-azabicyclo[2.2.2]octan-3-yl)benzamide IUPAC Name: 4-(2-acetylpyridin-4-yl)sulfanyl-N-(2-methyl-1-azabicyclo[2.2.2]octan-3-yl)benzamide Traditional Name: 4-[(2-acetyl-4-pyridyl)thio]-N-(2-methylquinuclidin-3-yl)benzamide Formula: C22H25N3O2S MolecularWeight: 395.5178

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C2CCN1CC2)NC(=O)C3=CC=C(C=C3)SC4=CC(=NC=C4)C(=O)C

Isomeric SMILES

CC1C(C2CCN1CC2)NC(=O)C3=CC=C(C=C3)SC4=CC(=NC=C4)C(=O)C

InChI

InChI=1S/C22H25N3O2S/c1-14-21(16-8-11-25(14)12-9-16)24-22(27)17-3-5-18(6-4-17)28-19-7-10-23-20(13-19)15(2)26/h3-7,10,13-14,16,21H,8-9,11-12H2,1-2H3,(H,24,27)