N-(1-azabicyclo[2.2.2]octan-3-yl)-5-(4-cyanophenyl)sulfanyl-thiophene-2-carboxamide

Systemtic Name: N-(1-azabicyclo[2.2.2]octan-3-yl)-5-(4-cyanophenyl)sulfanyl-thiophene-2-carboxamide Openeye Name: 5-(4-cyanophenyl)sulfanyl-N-quinuclidin-3-yl-thiophene-2-carboxamide CAS Name: N-(1-azabicyclo[2.2.2]octan-3-yl)-5-[(4-cyanophenyl)thio]-2-thiophenecarboxamide IUPAC Name: N-(1-azabicyclo[2.2.2]octan-3-yl)-5-(4-cyanophenyl)sulfanylthiophene-2-carboxamide Traditional Name: 5-[(4-cyanophenyl)thio]-N-quinuclidin-3-yl-thiophene-2-carboxamide Formula: C19H19N3OS2 MolecularWeight: 369.50366

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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