2-[(E)-2-(3,5-dimethoxyphenyl)ethenyl]-4-(2-pyridin-4-ylethylamino)quinazolin-6-ol

Systemtic Name: 2-[(E)-2-(3,5-dimethoxyphenyl)ethenyl]-4-(2-pyridin-4-ylethylamino)quinazolin-6-ol Openeye Name: 2-[(E)-2-(3,5-dimethoxyphenyl)vinyl]-4-[2-(4-pyridyl)ethylamino]quinazolin-6-ol CAS Name: 2-[(E)-2-(3,5-dimethoxyphenyl)ethenyl]-4-(2-pyridin-4-ylethylamino)-6-quinazolinol IUPAC Name: 2-[(E)-2-(3,5-dimethoxyphenyl)ethenyl]-4-(2-pyridin-4-ylethylamino)quinazolin-6-ol Traditional Name: 2-[(E)-2-(3,5-dimethoxyphenyl)vinyl]-4-[2-(4-pyridyl)ethylamino]quinazolin-6-ol Formula: C25H24N4O3 MolecularWeight: 428.48306

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C=CC2=NC3=C(C=C(C=C3)O)C(=N2)NCCC4=CC=NC=C4)OC

Isomeric SMILES

COC1=CC(=CC(=C1)/C=C/C2=NC3=C(C=C(C=C3)O)C(=N2)NCCC4=CC=NC=C4)OC

InChI

InChI=1S/C25H24N4O3/c1-31-20-13-18(14-21(16-20)32-2)3-6-24-28-23-5-4-19(30)15-22(23)25(29-24)27-12-9-17-7-10-26-11-8-17/h3-8,10-11,13-16,30H,9,12H2,1-2H3,(H,27,28,29)/b6-3+