3-[4-[6-(1H-pyrazol-4-yl)quinazolin-4-yl]piperazin-1-yl]benzenecarbonitrile

Systemtic Name: 3-[4-[6-(1H-pyrazol-4-yl)quinazolin-4-yl]piperazin-1-yl]benzenecarbonitrile Openeye Name: 3-[4-[6-(1H-pyrazol-4-yl)quinazolin-4-yl]piperazin-1-yl]benzonitrile CAS Name: 3-[4-[6-(1H-pyrazol-4-yl)-4-quinazolinyl]-1-piperazinyl]benzonitrile IUPAC Name: 3-[4-[6-(1H-pyrazol-4-yl)quinazolin-4-yl]piperazin-1-yl]benzonitrile Traditional Name: 3-[4-[6-(1H-pyrazol-4-yl)quinazolin-4-yl]piperazino]benzonitrile Formula: C22H19N7 MolecularWeight: 381.43316

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H19N7/c23-12-16-2-1-3-19(10-16)28-6-8-29(9-7-28)22-20-11-17(18-13-26-27-14-18)4-5-21(20)24-15-25-22/h1-5,10-11,13-15H,6-9H2,(H,26,27)