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

Systemtic Name: 2-fluoranyl-5-[4-[6-[1-(triphenylmethyl)pyrazol-4-yl]quinazolin-4-yl]piperazin-1-yl]benzenecarbonitrile Openeye Name: 2-fluoro-5-[4-[6-(1-tritylpyrazol-4-yl)quinazolin-4-yl]piperazin-1-yl]benzonitrile CAS Name: 2-fluoro-5-[4-[6-[1-(triphenylmethyl)-4-pyrazolyl]-4-quinazolinyl]-1-piperazinyl]benzonitrile IUPAC Name: 2-fluoro-5-[4-[6-(1-tritylpyrazol-4-yl)quinazolin-4-yl]piperazin-1-yl]benzonitrile Traditional Name: 2-fluoro-5-[4-[6-(1-tritylpyrazol-4-yl)quinazolin-4-yl]piperazino]benzonitrile Formula: C41H32FN7 MolecularWeight: 641.738083

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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=CN(N=C5)C(C6=CC=CC=C6)(C7=CC=CC=C7)C8=CC=CC=C8

Isomeric SMILES

C1CN(CCN1C2=CC(=C(C=C2)F)C#N)C3=NC=NC4=C3C=C(C=C4)C5=CN(N=C5)C(C6=CC=CC=C6)(C7=CC=CC=C7)C8=CC=CC=C8

InChI

InChI=1S/C41H32FN7/c42-38-18-17-36(24-31(38)26-43)47-20-22-48(23-21-47)40-37-25-30(16-19-39(37)44-29-45-40)32-27-46-49(28-32)41(33-10-4-1-5-11-33,34-12-6-2-7-13-34)35-14-8-3-9-15-35/h1-19,24-25,27-29H,20-23H2