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

Systemtic Name: 2-[2-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]pyrimidin-4-yl]-2-pyridin-2-yl-ethanenitrile Openeye Name: 2-[2-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]pyrimidin-4-yl]-2-(2-pyridyl)acetonitrile CAS Name: 2-[2-[4-[(2-fluorophenyl)methyl]-1-piperazinyl]-4-pyrimidinyl]-2-(2-pyridinyl)acetonitrile IUPAC Name: 2-[2-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]pyrimidin-4-yl]-2-pyridin-2-ylacetonitrile Traditional Name: 2-[2-[4-(2-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=C2F)C3=NC=CC(=N3)C(C#N)C4=CC=CC=N4

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2F)C3=NC=CC(=N3)C(C#N)C4=CC=CC=N4

InChI

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