4-[cyano-phenyl-(1,2,4-triazol-1-yl)methyl]benzenecarbonitrile

Systemtic Name: 4-[cyano-phenyl-(1,2,4-triazol-1-yl)methyl]benzenecarbonitrile Openeye Name: 4-[cyano-phenyl-(1,2,4-triazol-1-yl)methyl]benzonitrile CAS Name: 4-[cyano-phenyl-(1,2,4-triazol-1-yl)methyl]benzonitrile IUPAC Name: 4-[cyano-phenyl-(1,2,4-triazol-1-yl)methyl]benzonitrile Traditional Name: 4-[cyano-phenyl-(1,2,4-triazol-1-yl)methyl]benzonitrile Formula: C17H11N5 MolecularWeight: 285.30274

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C#N)(C2=CC=C(C=C2)C#N)N3C=NC=N3

Isomeric SMILES

C1=CC=C(C=C1)C(C#N)(C2=CC=C(C=C2)C#N)N3C=NC=N3

InChI

InChI=1S/C17H11N5/c18-10-14-6-8-16(9-7-14)17(11-19,22-13-20-12-21-22)15-4-2-1-3-5-15/h1-9,12-13H