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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)C(C2=CC=C(C=C2)C#N)N3C=NN=C3

Isomeric SMILES

C1=CC(=CC=C1C#N)C(C2=CC=C(C=C2)C#N)N3C=NN=C3

InChI

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