4-[3-(2-chloranylpyridin-4-yl)-1H-1,2,4-triazol-5-yl]pyridine-2-carbonitrile

Systemtic Name: 4-[3-(2-chloranylpyridin-4-yl)-1H-1,2,4-triazol-5-yl]pyridine-2-carbonitrile Openeye Name: 4-[3-(2-chloro-4-pyridyl)-1H-1,2,4-triazol-5-yl]pyridine-2-carbonitrile CAS Name: 4-[3-(2-chloro-4-pyridinyl)-1H-1,2,4-triazol-5-yl]-2-pyridinecarbonitrile IUPAC Name: 4-[3-(2-chloropyridin-4-yl)-1H-1,2,4-triazol-5-yl]pyridine-2-carbonitrile Traditional Name: 4-[3-(2-chloro-4-pyridyl)-1H-1,2,4-triazol-5-yl]picolinonitrile Formula: C13H7ClN6 MolecularWeight: 282.68788

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(C=C1C2=NC(=NN2)C3=CC(=NC=C3)Cl)C#N

Isomeric SMILES

C1=CN=C(C=C1C2=NC(=NN2)C3=CC(=NC=C3)Cl)C#N

InChI

InChI=1S/C13H7ClN6/c14-11-6-9(2-4-17-11)13-18-12(19-20-13)8-1-3-16-10(5-8)7-15/h1-6H,(H,18,19,20)