N-[5-(4-tert-butylphenyl)-1H-1,2,4-triazol-3-yl]-2-(2-fluoranylphenoxy)ethanamide

Systemtic Name: N-[5-(4-tert-butylphenyl)-1H-1,2,4-triazol-3-yl]-2-(2-fluoranylphenoxy)ethanamide Openeye Name: N-[5-(4-tert-butylphenyl)-1H-1,2,4-triazol-3-yl]-2-(2-fluorophenoxy)acetamide CAS Name: N-[5-(4-tert-butylphenyl)-1H-1,2,4-triazol-3-yl]-2-(2-fluorophenoxy)acetamide IUPAC Name: N-[5-(4-tert-butylphenyl)-1H-1,2,4-triazol-3-yl]-2-(2-fluorophenoxy)acetamide Traditional Name: N-[5-(4-tert-butylphenyl)-1H-1,2,4-triazol-3-yl]-2-(2-fluorophenoxy)acetamide Formula: C20H21FN4O2 MolecularWeight: 368.404743

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NC(=NN2)NC(=O)COC3=CC=CC=C3F

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NC(=NN2)NC(=O)COC3=CC=CC=C3F

InChI

InChI=1S/C20H21FN4O2/c1-20(2,3)14-10-8-13(9-11-14)18-23-19(25-24-18)22-17(26)12-27-16-7-5-4-6-15(16)21/h4-11H,12H2,1-3H3,(H2,22,23,24,25,26)