5-phenylsulfanyl-N-[2-(pyridin-3-ylmethyl)-1-azabicyclo[2.2.2]octan-3-yl]thiophene-2-carboxamide

Systemtic Name: 5-phenylsulfanyl-N-[2-(pyridin-3-ylmethyl)-1-azabicyclo[2.2.2]octan-3-yl]thiophene-2-carboxamide Openeye Name: 5-phenylsulfanyl-N-[2-(3-pyridylmethyl)quinuclidin-3-yl]thiophene-2-carboxamide CAS Name: 5-(phenylthio)-N-[2-(3-pyridinylmethyl)-1-azabicyclo[2.2.2]octan-3-yl]-2-thiophenecarboxamide IUPAC Name: 5-phenylsulfanyl-N-[2-(pyridin-3-ylmethyl)-1-azabicyclo[2.2.2]octan-3-yl]thiophene-2-carboxamide Traditional Name: 5-(phenylthio)-N-[2-(3-pyridylmethyl)quinuclidin-3-yl]thiophene-2-carboxamide Formula: C24H25N3OS2 MolecularWeight: 435.6048

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2CCC1C(C2CC3=CN=CC=C3)NC(=O)C4=CC=C(S4)SC5=CC=CC=C5

Isomeric SMILES

C1CN2CCC1C(C2CC3=CN=CC=C3)NC(=O)C4=CC=C(S4)SC5=CC=CC=C5

InChI

InChI=1S/C24H25N3OS2/c28-24(21-8-9-22(30-21)29-19-6-2-1-3-7-19)26-23-18-10-13-27(14-11-18)20(23)15-17-5-4-12-25-16-17/h1-9,12,16,18,20,23H,10-11,13-15H2,(H,26,28)