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

Systemtic Name: N-(1-azabicyclo[2.2.2]octan-3-ylcarbamothioyl)-2-methoxy-3-methyl-benzamide Openeye Name: 2-methoxy-3-methyl-N-(quinuclidin-3-ylcarbamothioyl)benzamide CAS Name: N-[(1-azabicyclo[2.2.2]octan-3-ylamino)-sulfanylidenemethyl]-2-methoxy-3-methylbenzamide IUPAC Name: N-(1-azabicyclo[2.2.2]octan-3-ylcarbamothioyl)-2-methoxy-3-methylbenzamide Traditional Name: 2-methoxy-3-methyl-N-(quinuclidin-3-ylthiocarbamoyl)benzamide Formula: C17H23N3O2S MolecularWeight: 333.44842

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1OC)C(=O)NC(=S)NC2CN3CCC2CC3

Isomeric SMILES

CC1=CC=CC(=C1OC)C(=O)NC(=S)NC2CN3CCC2CC3

InChI

InChI=1S/C17H23N3O2S/c1-11-4-3-5-13(15(11)22-2)16(21)19-17(23)18-14-10-20-8-6-12(14)7-9-20/h3-5,12,14H,6-10H2,1-2H3,(H2,18,19,21,23)