3-[4-(3-azabicyclo[2.2.1]heptan-5-ylcarbamoyl)phenyl]sulfanylbenzamide

Systemtic Name: 3-[4-(3-azabicyclo[2.2.1]heptan-5-ylcarbamoyl)phenyl]sulfanylbenzamide Openeye Name: 3-[4-(3-azabicyclo[2.2.1]heptan-5-ylcarbamoyl)phenyl]sulfanylbenzamide CAS Name: 3-[[4-[(3-azabicyclo[2.2.1]heptan-5-ylamino)-oxomethyl]phenyl]thio]benzamide IUPAC Name: 3-[4-(3-azabicyclo[2.2.1]heptan-5-ylcarbamoyl)phenyl]sulfanylbenzamide Traditional Name: 3-[[4-(3-azabicyclo[2.2.1]heptan-5-ylcarbamoyl)phenyl]thio]benzamide Formula: C20H21N3O2S MolecularWeight: 367.46464

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2CC(C1NC2)NC(=O)C3=CC=C(C=C3)SC4=CC=CC(=C4)C(=O)N

Isomeric SMILES

C1C2CC(C1NC2)NC(=O)C3=CC=C(C=C3)SC4=CC=CC(=C4)C(=O)N

InChI

InChI=1S/C20H21N3O2S/c21-19(24)14-2-1-3-16(10-14)26-15-6-4-13(5-7-15)20(25)23-18-9-12-8-17(18)22-11-12/h1-7,10,12,17-18,22H,8-9,11H2,(H2,21,24)(H,23,25)