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

Systemtic Name: 4-[4-[6-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]quinazolin-4-yl]piperazin-1-yl]benzenecarbonitrile Openeye Name: 4-[4-[6-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]quinazolin-4-yl]piperazin-1-yl]benzonitrile CAS Name: 4-[4-[6-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-4-quinazolinyl]-1-piperazinyl]benzonitrile IUPAC Name: 4-[4-[6-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]quinazolin-4-yl]piperazin-1-yl]benzonitrile Traditional Name: 4-[4-[6-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]quinazolin-4-yl]piperazino]benzonitrile Formula: C28H22FN7 MolecularWeight: 475.519583

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)C#N)C3=NC=NC4=C3C=C(C=C4)C5=C(NN=C5)C6=CC=C(C=C6)F

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)C#N)C3=NC=NC4=C3C=C(C=C4)C5=C(NN=C5)C6=CC=C(C=C6)F

InChI

InChI=1S/C28H22FN7/c29-22-6-3-20(4-7-22)27-25(17-33-34-27)21-5-10-26-24(15-21)28(32-18-31-26)36-13-11-35(12-14-36)23-8-1-19(16-30)2-9-23/h1-10,15,17-18H,11-14H2,(H,33,34)