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

Systemtic Name: 4-(3-aminophenyl)sulfanyl-N-(1-azabicyclo[2.2.2]octan-3-yl)benzamide Openeye Name: 4-(3-aminophenyl)sulfanyl-N-quinuclidin-3-yl-benzamide CAS Name: 4-[(3-aminophenyl)thio]-N-(1-azabicyclo[2.2.2]octan-3-yl)benzamide IUPAC Name: 4-(3-aminophenyl)sulfanyl-N-(1-azabicyclo[2.2.2]octan-3-yl)benzamide Traditional Name: 4-[(3-aminophenyl)thio]-N-quinuclidin-3-yl-benzamide Formula: C20H23N3OS MolecularWeight: 353.48112

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23N3OS/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,8-11,13,21H2,(H,22,24)