3-[4-(1-azabicyclo[3.2.2]nonan-3-ylcarbamoyl)phenyl]sulfanylbenzamide

Systemtic Name: 3-[4-(1-azabicyclo[3.2.2]nonan-3-ylcarbamoyl)phenyl]sulfanylbenzamide Openeye Name: 3-[4-(1-azabicyclo[3.2.2]nonan-3-ylcarbamoyl)phenyl]sulfanylbenzamide CAS Name: 3-[[4-[(1-azabicyclo[3.2.2]nonan-3-ylamino)-oxomethyl]phenyl]thio]benzamide IUPAC Name: 3-[4-(1-azabicyclo[3.2.2]nonan-3-ylcarbamoyl)phenyl]sulfanylbenzamide Traditional Name: 3-[[4-(1-azabicyclo[3.2.2]nonan-3-ylcarbamoyl)phenyl]thio]benzamide Formula: C22H25N3O2S MolecularWeight: 395.5178

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2CCC1CC(C2)NC(=O)C3=CC=C(C=C3)SC4=CC=CC(=C4)C(=O)N

Isomeric SMILES

C1CN2CCC1CC(C2)NC(=O)C3=CC=C(C=C3)SC4=CC=CC(=C4)C(=O)N

InChI

InChI=1S/C22H25N3O2S/c23-21(26)17-2-1-3-20(13-17)28-19-6-4-16(5-7-19)22(27)24-18-12-15-8-10-25(14-18)11-9-15/h1-7,13,15,18H,8-12,14H2,(H2,23,26)(H,24,27)