3-(5,6-dipyridin-2-yl-1,2,4-triazin-3-yl)isoquinoline

Systemtic Name: 3-(5,6-dipyridin-2-yl-1,2,4-triazin-3-yl)isoquinoline Openeye Name: 3-[5,6-bis(2-pyridyl)-1,2,4-triazin-3-yl]isoquinoline CAS Name: 3-[5,6-bis(2-pyridinyl)-1,2,4-triazin-3-yl]isoquinoline IUPAC Name: 3-(5,6-dipyridin-2-yl-1,2,4-triazin-3-yl)isoquinoline Traditional Name: 3-[5,6-bis(2-pyridyl)-1,2,4-triazin-3-yl]isoquinoline Formula: C22H14N6 MolecularWeight: 362.38676

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=NC(=CC2=C1)C3=NC(=C(N=N3)C4=CC=CC=N4)C5=CC=CC=N5

Isomeric SMILES

C1=CC=C2C=NC(=CC2=C1)C3=NC(=C(N=N3)C4=CC=CC=N4)C5=CC=CC=N5

InChI

InChI=1S/C22H14N6/c1-2-8-16-14-25-19(13-15(16)7-1)22-26-20(17-9-3-5-11-23-17)21(27-28-22)18-10-4-6-12-24-18/h1-14H