N-(3-chloranyl-4-fluoranyl-phenyl)-6-(oxan-4-yloxy)-7-phenylmethoxy-quinazolin-4-amine

Systemtic Name: N-(3-chloranyl-4-fluoranyl-phenyl)-6-(oxan-4-yloxy)-7-phenylmethoxy-quinazolin-4-amine Openeye Name: 7-benzyloxy-N-(3-chloro-4-fluoro-phenyl)-6-tetrahydropyran-4-yloxy-quinazolin-4-amine CAS Name: N-(3-chloro-4-fluorophenyl)-6-(4-oxanyloxy)-7-phenylmethoxy-4-quinazolinamine IUPAC Name: N-(3-chloro-4-fluorophenyl)-6-(oxan-4-yloxy)-7-phenylmethoxyquinazolin-4-amine Traditional Name: (7-benzoxy-6-tetrahydropyran-4-yloxy-quinazolin-4-yl)-(3-chloro-4-fluoro-phenyl)amine Formula: C26H23ClFN3O3 MolecularWeight: 479.930523

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1OC2=C(C=C3C(=C2)C(=NC=N3)NC4=CC(=C(C=C4)F)Cl)OCC5=CC=CC=C5

Isomeric SMILES

C1COCCC1OC2=C(C=C3C(=C2)C(=NC=N3)NC4=CC(=C(C=C4)F)Cl)OCC5=CC=CC=C5

InChI

InChI=1S/C26H23ClFN3O3/c27-21-12-18(6-7-22(21)28)31-26-20-13-25(34-19-8-10-32-11-9-19)24(14-23(20)29-16-30-26)33-15-17-4-2-1-3-5-17/h1-7,12-14,16,19H,8-11,15H2,(H,29,30,31)