4-[3-(4-fluorophenyl)-5-prop-2-enyl-1,2,4-triazol-1-yl]benzenecarbonitrile

Systemtic Name: 4-[3-(4-fluorophenyl)-5-prop-2-enyl-1,2,4-triazol-1-yl]benzenecarbonitrile Openeye Name: 4-[5-allyl-3-(4-fluorophenyl)-1,2,4-triazol-1-yl]benzonitrile CAS Name: 4-[3-(4-fluorophenyl)-5-prop-2-enyl-1,2,4-triazol-1-yl]benzonitrile IUPAC Name: 4-[3-(4-fluorophenyl)-5-prop-2-enyl-1,2,4-triazol-1-yl]benzonitrile Traditional Name: 4-[5-allyl-3-(4-fluorophenyl)-1,2,4-triazol-1-yl]benzonitrile Formula: C18H13FN4 MolecularWeight: 304.321023

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1=NC(=NN1C2=CC=C(C=C2)C#N)C3=CC=C(C=C3)F

Isomeric SMILES

C=CCC1=NC(=NN1C2=CC=C(C=C2)C#N)C3=CC=C(C=C3)F

InChI

InChI=1S/C18H13FN4/c1-2-3-17-21-18(14-6-8-15(19)9-7-14)22-23(17)16-10-4-13(12-20)5-11-16/h2,4-11H,1,3H2