2-[4-(5-chloranyl-2-fluoranyl-phenyl)carbonylpiperazin-1-yl]-N-(1-cyanocycloheptyl)ethanamide

Systemtic Name: 2-[4-(5-chloranyl-2-fluoranyl-phenyl)carbonylpiperazin-1-yl]-N-(1-cyanocycloheptyl)ethanamide Openeye Name: 2-[4-(5-chloro-2-fluoro-benzoyl)piperazin-1-yl]-N-(1-cyanocycloheptyl)acetamide CAS Name: 2-[4-[(5-chloro-2-fluorophenyl)-oxomethyl]-1-piperazinyl]-N-(1-cyanocycloheptyl)acetamide IUPAC Name: 2-[4-(5-chloro-2-fluorobenzoyl)piperazin-1-yl]-N-(1-cyanocycloheptyl)acetamide Traditional Name: 2-[4-(5-chloro-2-fluoro-benzoyl)piperazino]-N-(1-cyanocycloheptyl)acetamide Formula: C21H26ClFN4O2 MolecularWeight: 420.908143

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)(C#N)NC(=O)CN2CCN(CC2)C(=O)C3=C(C=CC(=C3)Cl)F

Isomeric SMILES

C1CCCC(CC1)(C#N)NC(=O)CN2CCN(CC2)C(=O)C3=C(C=CC(=C3)Cl)F

InChI

InChI=1S/C21H26ClFN4O2/c22-16-5-6-18(23)17(13-16)20(29)27-11-9-26(10-12-27)14-19(28)25-21(15-24)7-3-1-2-4-8-21/h5-6,13H,1-4,7-12,14H2,(H,25,28)