N-(5-tert-butyl-2-methoxy-phenyl)-1-[2-(trifluoromethyl)phenyl]-1,2,3-triazole-4-carboxamide

Systemtic Name: N-(5-tert-butyl-2-methoxy-phenyl)-1-[2-(trifluoromethyl)phenyl]-1,2,3-triazole-4-carboxamide Openeye Name: N-(5-tert-butyl-2-methoxy-phenyl)-1-[2-(trifluoromethyl)phenyl]triazole-4-carboxamide CAS Name: N-(5-tert-butyl-2-methoxyphenyl)-1-[2-(trifluoromethyl)phenyl]-4-triazolecarboxamide IUPAC Name: N-(5-tert-butyl-2-methoxyphenyl)-1-[2-(trifluoromethyl)phenyl]triazole-4-carboxamide Traditional Name: N-(5-tert-butyl-2-methoxy-phenyl)-1-[2-(trifluoromethyl)phenyl]triazole-4-carboxamide Formula: C21H21F3N4O2 MolecularWeight: 418.41225

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)OC)NC(=O)C2=CN(N=N2)C3=CC=CC=C3C(F)(F)F

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)OC)NC(=O)C2=CN(N=N2)C3=CC=CC=C3C(F)(F)F

InChI

InChI=1S/C21H21F3N4O2/c1-20(2,3)13-9-10-18(30-4)15(11-13)25-19(29)16-12-28(27-26-16)17-8-6-5-7-14(17)21(22,23)24/h5-12H,1-4H3,(H,25,29)