3-(4-fluorophenyl)-5-(1,2,4-triazol-1-ylmethyl)benzenecarbonitrile

Systemtic Name: 3-(4-fluorophenyl)-5-(1,2,4-triazol-1-ylmethyl)benzenecarbonitrile Openeye Name: 3-(4-fluorophenyl)-5-(1,2,4-triazol-1-ylmethyl)benzonitrile CAS Name: 3-(4-fluorophenyl)-5-(1,2,4-triazol-1-ylmethyl)benzonitrile IUPAC Name: 3-(4-fluorophenyl)-5-(1,2,4-triazol-1-ylmethyl)benzonitrile Traditional Name: 3-(4-fluorophenyl)-5-(1,2,4-triazol-1-ylmethyl)benzonitrile Formula: C16H11FN4 MolecularWeight: 278.283743

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CC(=CC(=C2)C#N)CN3C=NC=N3)F

Isomeric SMILES

C1=CC(=CC=C1C2=CC(=CC(=C2)C#N)CN3C=NC=N3)F

InChI

InChI=1S/C16H11FN4/c17-16-3-1-14(2-4-16)15-6-12(8-18)5-13(7-15)9-21-11-19-10-20-21/h1-7,10-11H,9H2