3-[4-(2-azabicyclo[2.2.1]heptan-5-ylcarbamoyl)phenyl]sulfanylbenzamide

Systemtic Name: 3-[4-(2-azabicyclo[2.2.1]heptan-5-ylcarbamoyl)phenyl]sulfanylbenzamide Openeye Name: 3-[4-(2-azabicyclo[2.2.1]heptan-5-ylcarbamoyl)phenyl]sulfanylbenzamide CAS Name: 3-[[4-[(2-azabicyclo[2.2.1]heptan-5-ylamino)-oxomethyl]phenyl]thio]benzamide IUPAC Name: 3-[4-(2-azabicyclo[2.2.1]heptan-5-ylcarbamoyl)phenyl]sulfanylbenzamide Traditional Name: 3-[[4-(2-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(C1CN2)NC(=O)C3=CC=C(C=C3)SC4=CC=CC(=C4)C(=O)N

Isomeric SMILES

C1C2CC(C1CN2)NC(=O)C3=CC=C(C=C3)SC4=CC=CC(=C4)C(=O)N

InChI

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