N-(1-azabicyclo[2.2.2]octan-3-yl)-5-(3-cyanophenyl)sulfanyl-thiophene-2-carboxamide

Systemtic Name: N-(1-azabicyclo[2.2.2]octan-3-yl)-5-(3-cyanophenyl)sulfanyl-thiophene-2-carboxamide Openeye Name: 5-(3-cyanophenyl)sulfanyl-N-quinuclidin-3-yl-thiophene-2-carboxamide CAS Name: N-(1-azabicyclo[2.2.2]octan-3-yl)-5-[(3-cyanophenyl)thio]-2-thiophenecarboxamide IUPAC Name: N-(1-azabicyclo[2.2.2]octan-3-yl)-5-(3-cyanophenyl)sulfanylthiophene-2-carboxamide Traditional Name: 5-[(3-cyanophenyl)thio]-N-quinuclidin-3-yl-thiophene-2-carboxamide Formula: C19H19N3OS2 MolecularWeight: 369.50366

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN2CCC1C(C2)NC(=O)C3=CC=C(S3)SC4=CC=CC(=C4)C#N

Isomeric SMILES

C1CN2CCC1C(C2)NC(=O)C3=CC=C(S3)SC4=CC=CC(=C4)C#N

InChI

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