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

Systemtic Name: 4-[(4-cyanophenyl)-fluoranyl-(1H-1,2,4-triazol-5-yl)methyl]benzenecarbonitrile Openeye Name: 4-[(4-cyanophenyl)-fluoro-(1H-1,2,4-triazol-5-yl)methyl]benzonitrile CAS Name: 4-[(4-cyanophenyl)-fluoro-(1H-1,2,4-triazol-5-yl)methyl]benzonitrile IUPAC Name: 4-[(4-cyanophenyl)-fluoro-(1H-1,2,4-triazol-5-yl)methyl]benzonitrile Traditional Name: 4-[(4-cyanophenyl)-fluoro-(1H-1,2,4-triazol-5-yl)methyl]benzonitrile Formula: C17H10FN5 MolecularWeight: 303.293203

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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)F

Isomeric SMILES

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

InChI

InChI=1S/C17H10FN5/c18-17(16-21-11-22-23-16,14-5-1-12(9-19)2-6-14)15-7-3-13(10-20)4-8-15/h1-8,11H,(H,21,22,23)