N-[(3R)-1-azabicyclo[2.2.2]octan-3-yl]-6-pyridin-3-yl-1,2-benzothiazole-3-carboxamide

Systemtic Name: N-[(3R)-1-azabicyclo[2.2.2]octan-3-yl]-6-pyridin-3-yl-1,2-benzothiazole-3-carboxamide Openeye Name: 6-(3-pyridyl)-N-[(3R)-quinuclidin-3-yl]-1,2-benzothiazole-3-carboxamide CAS Name: N-[(3R)-1-azabicyclo[2.2.2]octan-3-yl]-6-(3-pyridinyl)-1,2-benzothiazole-3-carboxamide IUPAC Name: N-[(3R)-1-azabicyclo[2.2.2]octan-3-yl]-6-pyridin-3-yl-1,2-benzothiazole-3-carboxamide Traditional Name: 6-(3-pyridyl)-N-[(3R)-quinuclidin-3-yl]-1,2-benzothiazole-3-carboxamide Formula: C20H20N4OS MolecularWeight: 364.464

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN2CCC1C(C2)NC(=O)C3=NSC4=C3C=CC(=C4)C5=CN=CC=C5

Isomeric SMILES

C1CN2CCC1[C@H](C2)NC(=O)C3=NSC4=C3C=CC(=C4)C5=CN=CC=C5

InChI

InChI=1S/C20H20N4OS/c25-20(22-17-12-24-8-5-13(17)6-9-24)19-16-4-3-14(10-18(16)26-23-19)15-2-1-7-21-11-15/h1-4,7,10-11,13,17H,5-6,8-9,12H2,(H,22,25)/t17-/m0/s1