N-(1-azabicyclo[2.2.2]octan-3-ylcarbamothioyl)-2-iodanyl-benzamide

Systemtic Name: N-(1-azabicyclo[2.2.2]octan-3-ylcarbamothioyl)-2-iodanyl-benzamide Openeye Name: 2-iodo-N-(quinuclidin-3-ylcarbamothioyl)benzamide CAS Name: N-[(1-azabicyclo[2.2.2]octan-3-ylamino)-sulfanylidenemethyl]-2-iodobenzamide IUPAC Name: N-(1-azabicyclo[2.2.2]octan-3-ylcarbamothioyl)-2-iodobenzamide Traditional Name: 2-iodo-N-(quinuclidin-3-ylthiocarbamoyl)benzamide Formula: C15H18IN3OS MolecularWeight: 415.29239

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN2CCC1C(C2)NC(=S)NC(=O)C3=CC=CC=C3I

Isomeric SMILES

C1CN2CCC1C(C2)NC(=S)NC(=O)C3=CC=CC=C3I

InChI

InChI=1S/C15H18IN3OS/c16-12-4-2-1-3-11(12)14(20)18-15(21)17-13-9-19-7-5-10(13)6-8-19/h1-4,10,13H,5-9H2,(H2,17,18,20,21)