4-[2-[4-[[4-(phenylmethyl)phenyl]amino]quinazolin-6-yl]ethynyl]oxan-4-ol

Systemtic Name: 4-[2-[4-[[4-(phenylmethyl)phenyl]amino]quinazolin-6-yl]ethynyl]oxan-4-ol Openeye Name: 4-[2-[4-(4-benzylanilino)quinazolin-6-yl]ethynyl]tetrahydropyran-4-ol CAS Name: 4-[2-[4-[4-(phenylmethyl)anilino]-6-quinazolinyl]ethynyl]-4-oxanol IUPAC Name: 4-[2-[4-(4-benzylanilino)quinazolin-6-yl]ethynyl]oxan-4-ol Traditional Name: 4-[2-[4-(4-benzylanilino)quinazolin-6-yl]ethynyl]tetrahydropyran-4-ol Formula: C28H25N3O2 MolecularWeight: 435.517

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1(C#CC2=CC3=C(C=C2)N=CN=C3NC4=CC=C(C=C4)CC5=CC=CC=C5)O

Isomeric SMILES

C1COCCC1(C#CC2=CC3=C(C=C2)N=CN=C3NC4=CC=C(C=C4)CC5=CC=CC=C5)O

InChI

InChI=1S/C28H25N3O2/c32-28(14-16-33-17-15-28)13-12-23-8-11-26-25(19-23)27(30-20-29-26)31-24-9-6-22(7-10-24)18-21-4-2-1-3-5-21/h1-11,19-20,32H,14-18H2,(H,29,30,31)