2-[2-[4-[(3-fluorophenyl)methyl]piperazin-1-yl]pyrimidin-4-yl]-2-pyridin-2-yl-ethanenitrile

Systemtic Name: 2-[2-[4-[(3-fluorophenyl)methyl]piperazin-1-yl]pyrimidin-4-yl]-2-pyridin-2-yl-ethanenitrile Openeye Name: 2-[2-[4-[(3-fluorophenyl)methyl]piperazin-1-yl]pyrimidin-4-yl]-2-(2-pyridyl)acetonitrile CAS Name: 2-[2-[4-[(3-fluorophenyl)methyl]-1-piperazinyl]-4-pyrimidinyl]-2-(2-pyridinyl)acetonitrile IUPAC Name: 2-[2-[4-[(3-fluorophenyl)methyl]piperazin-1-yl]pyrimidin-4-yl]-2-pyridin-2-ylacetonitrile Traditional Name: 2-[2-[4-(3-fluorobenzyl)piperazino]pyrimidin-4-yl]-2-(2-pyridyl)acetonitrile Formula: C22H21FN6 MolecularWeight: 388.440743

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC(=CC=C2)F)C3=NC=CC(=N3)C(C#N)C4=CC=CC=N4

Isomeric SMILES

C1CN(CCN1CC2=CC(=CC=C2)F)C3=NC=CC(=N3)C(C#N)C4=CC=CC=N4

InChI

InChI=1S/C22H21FN6/c23-18-5-3-4-17(14-18)16-28-10-12-29(13-11-28)22-26-9-7-21(27-22)19(15-24)20-6-1-2-8-25-20/h1-9,14,19H,10-13,16H2