1-[[4-(2-cyanophenyl)phenyl]methyl]-1,2,4-triazole-3-carbonitrile

Systemtic Name: 1-[[4-(2-cyanophenyl)phenyl]methyl]-1,2,4-triazole-3-carbonitrile Openeye Name: 1-[[4-(2-cyanophenyl)phenyl]methyl]-1,2,4-triazole-3-carbonitrile CAS Name: 1-[[4-(2-cyanophenyl)phenyl]methyl]-1,2,4-triazole-3-carbonitrile IUPAC Name: 1-[[4-(2-cyanophenyl)phenyl]methyl]-1,2,4-triazole-3-carbonitrile Traditional Name: 1-[4-(2-cyanophenyl)benzyl]-1,2,4-triazole-3-carbonitrile Formula: C17H11N5 MolecularWeight: 285.30274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C#N)C2=CC=C(C=C2)CN3C=NC(=N3)C#N

Isomeric SMILES

C1=CC=C(C(=C1)C#N)C2=CC=C(C=C2)CN3C=NC(=N3)C#N

InChI

InChI=1S/C17H11N5/c18-9-15-3-1-2-4-16(15)14-7-5-13(6-8-14)11-22-12-20-17(10-19)21-22/h1-8,12H,11H2