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

Systemtic Name: N-(1-azabicyclo[2.2.2]octan-3-yl)-4-(3-chlorophenyl)sulfanyl-benzamide Openeye Name: 4-(3-chlorophenyl)sulfanyl-N-quinuclidin-3-yl-benzamide CAS Name: N-(1-azabicyclo[2.2.2]octan-3-yl)-4-[(3-chlorophenyl)thio]benzamide IUPAC Name: N-(1-azabicyclo[2.2.2]octan-3-yl)-4-(3-chlorophenyl)sulfanylbenzamide Traditional Name: 4-[(3-chlorophenyl)thio]-N-quinuclidin-3-yl-benzamide Formula: C20H21ClN2OS MolecularWeight: 372.91154

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2CCC1C(C2)NC(=O)C3=CC=C(C=C3)SC4=CC(=CC=C4)Cl

Isomeric SMILES

C1CN2CCC1C(C2)NC(=O)C3=CC=C(C=C3)SC4=CC(=CC=C4)Cl

InChI

InChI=1S/C20H21ClN2OS/c21-16-2-1-3-18(12-16)25-17-6-4-15(5-7-17)20(24)22-19-13-23-10-8-14(19)9-11-23/h1-7,12,14,19H,8-11,13H2,(H,22,24)