6-[5-(6-cyanopyridin-2-yl)-1-(phenylmethyl)-1,2,4-triazol-3-yl]pyridine-2-carbonitrile

Systemtic Name: 6-[5-(6-cyanopyridin-2-yl)-1-(phenylmethyl)-1,2,4-triazol-3-yl]pyridine-2-carbonitrile Openeye Name: 6-[1-benzyl-5-(6-cyano-2-pyridyl)-1,2,4-triazol-3-yl]pyridine-2-carbonitrile CAS Name: 6-[5-(6-cyano-2-pyridinyl)-1-(phenylmethyl)-1,2,4-triazol-3-yl]-2-pyridinecarbonitrile IUPAC Name: 6-[1-benzyl-5-(6-cyanopyridin-2-yl)-1,2,4-triazol-3-yl]pyridine-2-carbonitrile Traditional Name: 6-[1-benzyl-5-(6-cyano-2-pyridyl)-1,2,4-triazol-3-yl]picolinonitrile Formula: C21H13N7 MolecularWeight: 363.37482

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=NC(=N2)C3=CC=CC(=N3)C#N)C4=CC=CC(=N4)C#N

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=NC(=N2)C3=CC=CC(=N3)C#N)C4=CC=CC(=N4)C#N

InChI

InChI=1S/C21H13N7/c22-12-16-8-4-10-18(24-16)20-26-21(19-11-5-9-17(13-23)25-19)28(27-20)14-15-6-2-1-3-7-15/h1-11H,14H2