1-[3-fluoranyl-4-[4-(2-pyridin-3-ylquinazolin-4-yl)piperazin-1-yl]phenyl]ethanone

Systemtic Name: 1-[3-fluoranyl-4-[4-(2-pyridin-3-ylquinazolin-4-yl)piperazin-1-yl]phenyl]ethanone Openeye Name: 1-[3-fluoro-4-[4-[2-(3-pyridyl)quinazolin-4-yl]piperazin-1-yl]phenyl]ethanone CAS Name: 1-[3-fluoro-4-[4-[2-(3-pyridinyl)-4-quinazolinyl]-1-piperazinyl]phenyl]ethanone IUPAC Name: 1-[3-fluoro-4-[4-(2-pyridin-3-ylquinazolin-4-yl)piperazin-1-yl]phenyl]ethanone Traditional Name: 1-[3-fluoro-4-[4-[2-(3-pyridyl)quinazolin-4-yl]piperazino]phenyl]ethanone Formula: C25H22FN5O MolecularWeight: 427.473483

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C3=NC(=NC4=CC=CC=C43)C5=CN=CC=C5)F

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C3=NC(=NC4=CC=CC=C43)C5=CN=CC=C5)F

InChI

InChI=1S/C25H22FN5O/c1-17(32)18-8-9-23(21(26)15-18)30-11-13-31(14-12-30)25-20-6-2-3-7-22(20)28-24(29-25)19-5-4-10-27-16-19/h2-10,15-16H,11-14H2,1H3