4-[4-[(3-fluoranyl-4-methoxy-phenyl)methyl]piperazin-1-yl]-2-pyridin-3-yl-quinazoline

Systemtic Name: 4-[4-[(3-fluoranyl-4-methoxy-phenyl)methyl]piperazin-1-yl]-2-pyridin-3-yl-quinazoline Openeye Name: 4-[4-[(3-fluoro-4-methoxy-phenyl)methyl]piperazin-1-yl]-2-(3-pyridyl)quinazoline CAS Name: 4-[4-[(3-fluoro-4-methoxyphenyl)methyl]-1-piperazinyl]-2-(3-pyridinyl)quinazoline IUPAC Name: 4-[4-[(3-fluoro-4-methoxyphenyl)methyl]piperazin-1-yl]-2-pyridin-3-ylquinazoline Traditional Name: 4-[4-(3-fluoro-4-methoxy-benzyl)piperazino]-2-(3-pyridyl)quinazoline Formula: C25H24FN5O MolecularWeight: 429.489363

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2CCN(CC2)C3=NC(=NC4=CC=CC=C43)C5=CN=CC=C5)F

Isomeric SMILES

COC1=C(C=C(C=C1)CN2CCN(CC2)C3=NC(=NC4=CC=CC=C43)C5=CN=CC=C5)F

InChI

InChI=1S/C25H24FN5O/c1-32-23-9-8-18(15-21(23)26)17-30-11-13-31(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,11-14,17H2,1H3