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

Systemtic Name: N-(1-azabicyclo[2.2.2]octan-3-yl)-4-[(2-ethanoyl-1H-imidazol-5-yl)sulfanyl]benzamide Openeye Name: 4-[(2-acetyl-1H-imidazol-5-yl)sulfanyl]-N-quinuclidin-3-yl-benzamide CAS Name: 4-[(2-acetyl-1H-imidazol-5-yl)thio]-N-(1-azabicyclo[2.2.2]octan-3-yl)benzamide IUPAC Name: 4-[(2-acetyl-1H-imidazol-5-yl)sulfanyl]-N-(1-azabicyclo[2.2.2]octan-3-yl)benzamide Traditional Name: 4-[(2-acetyl-1H-imidazol-5-yl)thio]-N-quinuclidin-3-yl-benzamide Formula: C19H22N4O2S MolecularWeight: 370.46858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=NC=C(N1)SC2=CC=C(C=C2)C(=O)NC3CN4CCC3CC4

Isomeric SMILES

CC(=O)C1=NC=C(N1)SC2=CC=C(C=C2)C(=O)NC3CN4CCC3CC4

InChI

InChI=1S/C19H22N4O2S/c1-12(24)18-20-10-17(22-18)26-15-4-2-14(3-5-15)19(25)21-16-11-23-8-6-13(16)7-9-23/h2-5,10,13,16H,6-9,11H2,1H3,(H,20,22)(H,21,25)