2-(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)quinoline

Systemtic Name: 2-(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)quinoline Openeye Name: 2-[3-(4-pyridyl)-1H-1,2,4-triazol-5-yl]quinoline CAS Name: 2-(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)quinoline IUPAC Name: 2-(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)quinoline Traditional Name: 2-[3-(4-pyridyl)-1H-1,2,4-triazol-5-yl]quinoline Formula: C16H11N5 MolecularWeight: 273.29204

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)C3=NC(=NN3)C4=CC=NC=C4

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)C3=NC(=NN3)C4=CC=NC=C4

InChI

InChI=1S/C16H11N5/c1-2-4-13-11(3-1)5-6-14(18-13)16-19-15(20-21-16)12-7-9-17-10-8-12/h1-10H,(H,19,20,21)