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

Systemtic Name: N-[(3R)-1-azabicyclo[2.2.2]octan-3-yl]-6-thiophen-3-yl-1,2-benzothiazole-3-carboxamide Openeye Name: N-[(3R)-quinuclidin-3-yl]-6-(3-thienyl)-1,2-benzothiazole-3-carboxamide CAS Name: N-[(3R)-1-azabicyclo[2.2.2]octan-3-yl]-6-(3-thiophenyl)-1,2-benzothiazole-3-carboxamide IUPAC Name: N-[(3R)-1-azabicyclo[2.2.2]octan-3-yl]-6-thiophen-3-yl-1,2-benzothiazole-3-carboxamide Traditional Name: N-[(3R)-quinuclidin-3-yl]-6-(3-thienyl)-1,2-benzothiazole-3-carboxamide Formula: C19H19N3OS2 MolecularWeight: 369.50366

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19N3OS2/c23-19(20-16-10-22-6-3-12(16)4-7-22)18-15-2-1-13(9-17(15)25-21-18)14-5-8-24-11-14/h1-2,5,8-9,11-12,16H,3-4,6-7,10H2,(H,20,23)/t16-/m0/s1