N-[(3S)-1-azabicyclo[2.2.2]octan-3-yl]-6-pyridin-4-yl-1,2-benzothiazole-3-carboxamide

Systemtic Name: N-[(3S)-1-azabicyclo[2.2.2]octan-3-yl]-6-pyridin-4-yl-1,2-benzothiazole-3-carboxamide Openeye Name: 6-(4-pyridyl)-N-[(3S)-quinuclidin-3-yl]-1,2-benzothiazole-3-carboxamide CAS Name: N-[(3S)-1-azabicyclo[2.2.2]octan-3-yl]-6-pyridin-4-yl-1,2-benzothiazole-3-carboxamide IUPAC Name: N-[(3S)-1-azabicyclo[2.2.2]octan-3-yl]-6-pyridin-4-yl-1,2-benzothiazole-3-carboxamide Traditional Name: 6-(4-pyridyl)-N-[(3S)-quinuclidin-3-yl]-1,2-benzothiazole-3-carboxamide Formula: C20H20N4OS MolecularWeight: 364.464

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20N4OS/c25-20(22-17-12-24-9-5-14(17)6-10-24)19-16-2-1-15(11-18(16)26-23-19)13-3-7-21-8-4-13/h1-4,7-8,11,14,17H,5-6,9-10,12H2,(H,22,25)/t17-/m1/s1