5-[4-[3-[1-(4-fluorophenyl)cyclohexyl]propyl]piperazin-1-yl]-2-propan-2-yl-2-thiophen-2-yl-pentanenitrile

Systemtic Name: 5-[4-[3-[1-(4-fluorophenyl)cyclohexyl]propyl]piperazin-1-yl]-2-propan-2-yl-2-thiophen-2-yl-pentanenitrile Openeye Name: 5-[4-[3-[1-(4-fluorophenyl)cyclohexyl]propyl]piperazin-1-yl]-2-isopropyl-2-(2-thienyl)pentanenitrile CAS Name: 5-[4-[3-[1-(4-fluorophenyl)cyclohexyl]propyl]-1-piperazinyl]-2-propan-2-yl-2-thiophen-2-ylpentanenitrile IUPAC Name: 5-[4-[3-[1-(4-fluorophenyl)cyclohexyl]propyl]piperazin-1-yl]-2-propan-2-yl-2-thiophen-2-ylpentanenitrile Traditional Name: 5-[4-[3-[1-(4-fluorophenyl)cyclohexyl]propyl]piperazino]-2-isopropyl-2-(2-thienyl)valeronitrile Formula: C31H44FN3S MolecularWeight: 509.764563

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCCN1CCN(CC1)CCCC2(CCCCC2)C3=CC=C(C=C3)F)(C#N)C4=CC=CS4

Isomeric SMILES

CC(C)C(CCCN1CCN(CC1)CCCC2(CCCCC2)C3=CC=C(C=C3)F)(C#N)C4=CC=CS4

InChI

InChI=1S/C31H44FN3S/c1-26(2)31(25-33,29-9-6-24-36-29)17-8-19-35-22-20-34(21-23-35)18-7-16-30(14-4-3-5-15-30)27-10-12-28(32)13-11-27/h6,9-13,24,26H,3-5,7-8,14-23H2,1-2H3