3-[4-(4-cyano-5-methyl-4-phenyl-hexyl)piperazin-1-yl]-N-(4-fluorophenyl)propanamide

Systemtic Name: 3-[4-(4-cyano-5-methyl-4-phenyl-hexyl)piperazin-1-yl]-N-(4-fluorophenyl)propanamide Openeye Name: 3-[4-(4-cyano-5-methyl-4-phenyl-hexyl)piperazin-1-yl]-N-(4-fluorophenyl)propanamide CAS Name: 3-[4-(4-cyano-5-methyl-4-phenylhexyl)-1-piperazinyl]-N-(4-fluorophenyl)propanamide IUPAC Name: 3-[4-(4-cyano-5-methyl-4-phenylhexyl)piperazin-1-yl]-N-(4-fluorophenyl)propanamide Traditional Name: 3-[4-(4-cyano-5-methyl-4-phenyl-hexyl)piperazino]-N-(4-fluorophenyl)propionamide Formula: C27H35FN4O MolecularWeight: 450.591403

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCCN1CCN(CC1)CCC(=O)NC2=CC=C(C=C2)F)(C#N)C3=CC=CC=C3

Isomeric SMILES

CC(C)C(CCCN1CCN(CC1)CCC(=O)NC2=CC=C(C=C2)F)(C#N)C3=CC=CC=C3

InChI

InChI=1S/C27H35FN4O/c1-22(2)27(21-29,23-7-4-3-5-8-23)14-6-15-31-17-19-32(20-18-31)16-13-26(33)30-25-11-9-24(28)10-12-25/h3-5,7-12,22H,6,13-20H2,1-2H3,(H,30,33)