3-phenyl-6-(pyrimidin-4-ylmethoxy)-[1,2,4]triazolo[3,4-a]phthalazine

Systemtic Name: 3-phenyl-6-(pyrimidin-4-ylmethoxy)-[1,2,4]triazolo[3,4-a]phthalazine Openeye Name: 3-phenyl-6-(pyrimidin-4-ylmethoxy)-[1,2,4]triazolo[3,4-a]phthalazine CAS Name: 3-phenyl-6-(4-pyrimidinylmethoxy)-[1,2,4]triazolo[3,4-a]phthalazine IUPAC Name: 3-phenyl-6-(pyrimidin-4-ylmethoxy)-[1,2,4]triazolo[3,4-a]phthalazine Traditional Name: 3-phenyl-6-(4-pyrimidylmethoxy)-[1,2,4]triazolo[3,4-a]phthalazine Formula: C20H14N6O MolecularWeight: 354.36476

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN=C3N2N=C(C4=CC=CC=C43)OCC5=NC=NC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=NN=C3N2N=C(C4=CC=CC=C43)OCC5=NC=NC=C5

InChI

InChI=1S/C20H14N6O/c1-2-6-14(7-3-1)18-23-24-19-16-8-4-5-9-17(16)20(25-26(18)19)27-12-15-10-11-21-13-22-15/h1-11,13H,12H2