2-phenyl-4-pyridin-2-yl-2-(1,2,4-triazol-1-ylmethyl)butanenitrile

Systemtic Name: 2-phenyl-4-pyridin-2-yl-2-(1,2,4-triazol-1-ylmethyl)butanenitrile Openeye Name: 2-phenyl-4-(2-pyridyl)-2-(1,2,4-triazol-1-ylmethyl)butanenitrile CAS Name: 2-phenyl-4-(2-pyridinyl)-2-(1,2,4-triazol-1-ylmethyl)butanenitrile IUPAC Name: 2-phenyl-4-pyridin-2-yl-2-(1,2,4-triazol-1-ylmethyl)butanenitrile Traditional Name: 2-phenyl-4-(2-pyridyl)-2-(1,2,4-triazol-1-ylmethyl)butyronitrile Formula: C18H17N5 MolecularWeight: 303.36108

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CCC2=CC=CC=N2)(CN3C=NC=N3)C#N

Isomeric SMILES

C1=CC=C(C=C1)C(CCC2=CC=CC=N2)(CN3C=NC=N3)C#N

InChI

InChI=1S/C18H17N5/c19-12-18(13-23-15-20-14-22-23,16-6-2-1-3-7-16)10-9-17-8-4-5-11-21-17/h1-8,11,14-15H,9-10,13H2