5-(4-tert-butylphenyl)-3-(3-fluorophenyl)-1H-1,2,4-triazole

Systemtic Name: 5-(4-tert-butylphenyl)-3-(3-fluorophenyl)-1H-1,2,4-triazole Openeye Name: 5-(4-tert-butylphenyl)-3-(3-fluorophenyl)-1H-1,2,4-triazole CAS Name: 5-(4-tert-butylphenyl)-3-(3-fluorophenyl)-1H-1,2,4-triazole IUPAC Name: 5-(4-tert-butylphenyl)-3-(3-fluorophenyl)-1H-1,2,4-triazole Traditional Name: 5-(4-tert-butylphenyl)-3-(3-fluorophenyl)-1H-1,2,4-triazole Formula: C18H18FN3 MolecularWeight: 295.354023

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NC(=NN2)C3=CC(=CC=C3)F

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NC(=NN2)C3=CC(=CC=C3)F

InChI

InChI=1S/C18H18FN3/c1-18(2,3)14-9-7-12(8-10-14)16-20-17(22-21-16)13-5-4-6-15(19)11-13/h4-11H,1-3H3,(H,20,21,22)