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

Systemtic Name: 4-(3-aminophenyl)sulfanyl-N-(2-methyl-1-azabicyclo[2.2.2]octan-3-yl)benzamide Openeye Name: 4-(3-aminophenyl)sulfanyl-N-(2-methylquinuclidin-3-yl)benzamide CAS Name: 4-[(3-aminophenyl)thio]-N-(2-methyl-1-azabicyclo[2.2.2]octan-3-yl)benzamide IUPAC Name: 4-(3-aminophenyl)sulfanyl-N-(2-methyl-1-azabicyclo[2.2.2]octan-3-yl)benzamide Traditional Name: 4-[(3-aminophenyl)thio]-N-(2-methylquinuclidin-3-yl)benzamide Formula: C21H25N3OS MolecularWeight: 367.5077

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C2CCN1CC2)NC(=O)C3=CC=C(C=C3)SC4=CC=CC(=C4)N

Isomeric SMILES

CC1C(C2CCN1CC2)NC(=O)C3=CC=C(C=C3)SC4=CC=CC(=C4)N

InChI

InChI=1S/C21H25N3OS/c1-14-20(15-9-11-24(14)12-10-15)23-21(25)16-5-7-18(8-6-16)26-19-4-2-3-17(22)13-19/h2-8,13-15,20H,9-12,22H2,1H3,(H,23,25)