5-[4-[4-cyano-4-(4-fluorophenyl)butyl]piperazin-1-yl]-2-phenyl-2-propan-2-yl-pentanenitrile

Systemtic Name: 5-[4-[4-cyano-4-(4-fluorophenyl)butyl]piperazin-1-yl]-2-phenyl-2-propan-2-yl-pentanenitrile Openeye Name: 5-[4-[4-cyano-4-(4-fluorophenyl)butyl]piperazin-1-yl]-2-isopropyl-2-phenyl-pentanenitrile CAS Name: 5-[4-[4-cyano-4-(4-fluorophenyl)butyl]-1-piperazinyl]-2-phenyl-2-propan-2-ylpentanenitrile IUPAC Name: 5-[4-[4-cyano-4-(4-fluorophenyl)butyl]piperazin-1-yl]-2-phenyl-2-propan-2-ylpentanenitrile Traditional Name: 5-[4-[4-cyano-4-(4-fluorophenyl)butyl]piperazino]-2-isopropyl-2-phenyl-valeronitrile Formula: C29H37FN4 MolecularWeight: 460.629283

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCCN1CCN(CC1)CCCC(C#N)C2=CC=C(C=C2)F)(C#N)C3=CC=CC=C3

Isomeric SMILES

CC(C)C(CCCN1CCN(CC1)CCCC(C#N)C2=CC=C(C=C2)F)(C#N)C3=CC=CC=C3

InChI

InChI=1S/C29H37FN4/c1-24(2)29(23-32,27-9-4-3-5-10-27)15-7-17-34-20-18-33(19-21-34)16-6-8-26(22-31)25-11-13-28(30)14-12-25/h3-5,9-14,24,26H,6-8,15-21H2,1-2H3