2-fluoranyl-5-[4-[6-(1H-pyrazol-4-yl)quinazolin-4-yl]piperazin-1-yl]benzenecarbonitrile

Systemtic Name: 2-fluoranyl-5-[4-[6-(1H-pyrazol-4-yl)quinazolin-4-yl]piperazin-1-yl]benzenecarbonitrile Openeye Name: 2-fluoro-5-[4-[6-(1H-pyrazol-4-yl)quinazolin-4-yl]piperazin-1-yl]benzonitrile CAS Name: 2-fluoro-5-[4-[6-(1H-pyrazol-4-yl)-4-quinazolinyl]-1-piperazinyl]benzonitrile IUPAC Name: 2-fluoro-5-[4-[6-(1H-pyrazol-4-yl)quinazolin-4-yl]piperazin-1-yl]benzonitrile Traditional Name: 2-fluoro-5-[4-[6-(1H-pyrazol-4-yl)quinazolin-4-yl]piperazino]benzonitrile Formula: C22H18FN7 MolecularWeight: 399.423623

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=C(C=C2)F)C#N)C3=NC=NC4=C3C=C(C=C4)C5=CNN=C5

Isomeric SMILES

C1CN(CCN1C2=CC(=C(C=C2)F)C#N)C3=NC=NC4=C3C=C(C=C4)C5=CNN=C5

InChI

InChI=1S/C22H18FN7/c23-20-3-2-18(9-16(20)11-24)29-5-7-30(8-6-29)22-19-10-15(17-12-27-28-13-17)1-4-21(19)25-14-26-22/h1-4,9-10,12-14H,5-8H2,(H,27,28)