N-(1-azabicyclo[2.2.2]octan-3-yl)-4-(4-cyanothiophen-2-yl)sulfanyl-benzamide

Systemtic Name: N-(1-azabicyclo[2.2.2]octan-3-yl)-4-(4-cyanothiophen-2-yl)sulfanyl-benzamide Openeye Name: 4-[(4-cyano-2-thienyl)sulfanyl]-N-quinuclidin-3-yl-benzamide CAS Name: N-(1-azabicyclo[2.2.2]octan-3-yl)-4-[(4-cyano-2-thiophenyl)thio]benzamide IUPAC Name: N-(1-azabicyclo[2.2.2]octan-3-yl)-4-(4-cyanothiophen-2-yl)sulfanylbenzamide Traditional Name: 4-[(4-cyano-2-thienyl)thio]-N-quinuclidin-3-yl-benzamide Formula: C19H19N3OS2 MolecularWeight: 369.50366

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2CCC1C(C2)NC(=O)C3=CC=C(C=C3)SC4=CC(=CS4)C#N

Isomeric SMILES

C1CN2CCC1C(C2)NC(=O)C3=CC=C(C=C3)SC4=CC(=CS4)C#N

InChI

InChI=1S/C19H19N3OS2/c20-10-13-9-18(24-12-13)25-16-3-1-15(2-4-16)19(23)21-17-11-22-7-5-14(17)6-8-22/h1-4,9,12,14,17H,5-8,11H2,(H,21,23)