3-(3,5-dipyridin-3-yl-1,2,4-triazol-1-yl)propanenitrile

Systemtic Name: 3-(3,5-dipyridin-3-yl-1,2,4-triazol-1-yl)propanenitrile Openeye Name: 3-[3,5-bis(3-pyridyl)-1,2,4-triazol-1-yl]propanenitrile CAS Name: 3-[3,5-bis(3-pyridinyl)-1,2,4-triazol-1-yl]propanenitrile IUPAC Name: 3-(3,5-dipyridin-3-yl-1,2,4-triazol-1-yl)propanenitrile Traditional Name: 3-[3,5-bis(3-pyridyl)-1,2,4-triazol-1-yl]propionitrile Formula: C15H12N6 MolecularWeight: 276.29598

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C2=NN(C(=N2)C3=CN=CC=C3)CCC#N

Isomeric SMILES

C1=CC(=CN=C1)C2=NN(C(=N2)C3=CN=CC=C3)CCC#N

InChI

InChI=1S/C15H12N6/c16-6-3-9-21-15(13-5-2-8-18-11-13)19-14(20-21)12-4-1-7-17-10-12/h1-2,4-5,7-8,10-11H,3,9H2