5-[4-[2-(4-fluoranylphenoxy)ethyl]piperazin-1-yl]-2-propan-2-yl-2-pyridin-4-yl-pentanenitrile

Systemtic Name: 5-[4-[2-(4-fluoranylphenoxy)ethyl]piperazin-1-yl]-2-propan-2-yl-2-pyridin-4-yl-pentanenitrile Openeye Name: 5-[4-[2-(4-fluorophenoxy)ethyl]piperazin-1-yl]-2-isopropyl-2-(4-pyridyl)pentanenitrile CAS Name: 5-[4-[2-(4-fluorophenoxy)ethyl]-1-piperazinyl]-2-propan-2-yl-2-pyridin-4-ylpentanenitrile IUPAC Name: 5-[4-[2-(4-fluorophenoxy)ethyl]piperazin-1-yl]-2-propan-2-yl-2-pyridin-4-ylpentanenitrile Traditional Name: 5-[4-[2-(4-fluorophenoxy)ethyl]piperazino]-2-isopropyl-2-(4-pyridyl)valeronitrile Formula: C25H33FN4O MolecularWeight: 424.554123

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCCN1CCN(CC1)CCOC2=CC=C(C=C2)F)(C#N)C3=CC=NC=C3

Isomeric SMILES

CC(C)C(CCCN1CCN(CC1)CCOC2=CC=C(C=C2)F)(C#N)C3=CC=NC=C3

InChI

InChI=1S/C25H33FN4O/c1-21(2)25(20-27,22-8-11-28-12-9-22)10-3-13-29-14-16-30(17-15-29)18-19-31-24-6-4-23(26)5-7-24/h4-9,11-12,21H,3,10,13-19H2,1-2H3