N-(2-azabicyclo[2.2.1]heptan-5-yl)-4-(1H-pyrrol-2-ylsulfanyl)benzamide

Systemtic Name: N-(2-azabicyclo[2.2.1]heptan-5-yl)-4-(1H-pyrrol-2-ylsulfanyl)benzamide Openeye Name: N-(2-azabicyclo[2.2.1]heptan-5-yl)-4-(1H-pyrrol-2-ylsulfanyl)benzamide CAS Name: N-(2-azabicyclo[2.2.1]heptan-5-yl)-4-(1H-pyrrol-2-ylthio)benzamide IUPAC Name: N-(2-azabicyclo[2.2.1]heptan-5-yl)-4-(1H-pyrrol-2-ylsulfanyl)benzamide Traditional Name: N-(2-azabicyclo[2.2.1]heptan-5-yl)-4-(1H-pyrrol-2-ylthio)benzamide Formula: C17H19N3OS MolecularWeight: 313.41726

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2CC(C1CN2)NC(=O)C3=CC=C(C=C3)SC4=CC=CN4

Isomeric SMILES

C1C2CC(C1CN2)NC(=O)C3=CC=C(C=C3)SC4=CC=CN4

InChI

InChI=1S/C17H19N3OS/c21-17(20-15-9-13-8-12(15)10-19-13)11-3-5-14(6-4-11)22-16-2-1-7-18-16/h1-7,12-13,15,18-19H,8-10H2,(H,20,21)