2-phenyl-5-(1H-1,2,4-triazol-5-ylmethyl)benzenecarbonitrile

Systemtic Name: 2-phenyl-5-(1H-1,2,4-triazol-5-ylmethyl)benzenecarbonitrile Openeye Name: 2-phenyl-5-(1H-1,2,4-triazol-5-ylmethyl)benzonitrile CAS Name: 2-phenyl-5-(1H-1,2,4-triazol-5-ylmethyl)benzonitrile IUPAC Name: 2-phenyl-5-(1H-1,2,4-triazol-5-ylmethyl)benzonitrile Traditional Name: 2-phenyl-5-(1H-1,2,4-triazol-5-ylmethyl)benzonitrile Formula: C16H12N4 MolecularWeight: 260.29328

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C=C(C=C2)CC3=NC=NN3)C#N

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C=C(C=C2)CC3=NC=NN3)C#N

InChI

InChI=1S/C16H12N4/c17-10-14-8-12(9-16-18-11-19-20-16)6-7-15(14)13-4-2-1-3-5-13/h1-8,11H,9H2,(H,18,19,20)