N-(1-azabicyclo[2.2.2]octan-3-ylcarbamothioyl)-4-tert-butyl-benzamide

Systemtic Name: N-(1-azabicyclo[2.2.2]octan-3-ylcarbamothioyl)-4-tert-butyl-benzamide Openeye Name: 4-tert-butyl-N-(quinuclidin-3-ylcarbamothioyl)benzamide CAS Name: N-[(1-azabicyclo[2.2.2]octan-3-ylamino)-sulfanylidenemethyl]-4-tert-butylbenzamide IUPAC Name: N-(1-azabicyclo[2.2.2]octan-3-ylcarbamothioyl)-4-tert-butylbenzamide Traditional Name: 4-tert-butyl-N-(quinuclidin-3-ylthiocarbamoyl)benzamide Formula: C19H27N3OS MolecularWeight: 345.50218

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC(=S)NC2CN3CCC2CC3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC(=S)NC2CN3CCC2CC3

InChI

InChI=1S/C19H27N3OS/c1-19(2,3)15-6-4-14(5-7-15)17(23)21-18(24)20-16-12-22-10-8-13(16)9-11-22/h4-7,13,16H,8-12H2,1-3H3,(H2,20,21,23,24)