4-[(4-cyanophenyl)-(1H-1,2,4-triazol-5-yl)methyl]benzenecarbonitrile

Systemtic Name: 4-[(4-cyanophenyl)-(1H-1,2,4-triazol-5-yl)methyl]benzenecarbonitrile Openeye Name: 4-[(4-cyanophenyl)-(1H-1,2,4-triazol-5-yl)methyl]benzonitrile CAS Name: 4-[(4-cyanophenyl)-(1H-1,2,4-triazol-5-yl)methyl]benzonitrile IUPAC Name: 4-[(4-cyanophenyl)-(1H-1,2,4-triazol-5-yl)methyl]benzonitrile Traditional Name: 4-[(4-cyanophenyl)-(1H-1,2,4-triazol-5-yl)methyl]benzonitrile Formula: C17H11N5 MolecularWeight: 285.30274

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)C(C2=CC=C(C=C2)C#N)C3=NC=NN3

Isomeric SMILES

C1=CC(=CC=C1C#N)C(C2=CC=C(C=C2)C#N)C3=NC=NN3

InChI

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