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

Systemtic Name: N-(1-azabicyclo[2.2.2]octan-3-ylcarbamothioyl)-4-propoxy-benzamide Openeye Name: 4-propoxy-N-(quinuclidin-3-ylcarbamothioyl)benzamide CAS Name: N-[(1-azabicyclo[2.2.2]octan-3-ylamino)-sulfanylidenemethyl]-4-propoxybenzamide IUPAC Name: N-(1-azabicyclo[2.2.2]octan-3-ylcarbamothioyl)-4-propoxybenzamide Traditional Name: 4-propoxy-N-(quinuclidin-3-ylthiocarbamoyl)benzamide Formula: C18H25N3O2S MolecularWeight: 347.475

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2CN3CCC2CC3

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2CN3CCC2CC3

InChI

InChI=1S/C18H25N3O2S/c1-2-11-23-15-5-3-14(4-6-15)17(22)20-18(24)19-16-12-21-9-7-13(16)8-10-21/h3-6,13,16H,2,7-12H2,1H3,(H2,19,20,22,24)