4-[5-(4-tert-butylphenyl)-3-(trifluoromethyl)-1,2,4-triazol-1-yl]benzenesulfonamide

Systemtic Name: 4-[5-(4-tert-butylphenyl)-3-(trifluoromethyl)-1,2,4-triazol-1-yl]benzenesulfonamide Openeye Name: 4-[5-(4-tert-butylphenyl)-3-(trifluoromethyl)-1,2,4-triazol-1-yl]benzenesulfonamide CAS Name: 4-[5-(4-tert-butylphenyl)-3-(trifluoromethyl)-1,2,4-triazol-1-yl]benzenesulfonamide IUPAC Name: 4-[5-(4-tert-butylphenyl)-3-(trifluoromethyl)-1,2,4-triazol-1-yl]benzenesulfonamide Traditional Name: 4-[5-(4-tert-butylphenyl)-3-(trifluoromethyl)-1,2,4-triazol-1-yl]benzenesulfonamide Formula: C19H19F3N4O2S MolecularWeight: 424.43997

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NC(=NN2C3=CC=C(C=C3)S(=O)(=O)N)C(F)(F)F

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NC(=NN2C3=CC=C(C=C3)S(=O)(=O)N)C(F)(F)F

InChI

InChI=1S/C19H19F3N4O2S/c1-18(2,3)13-6-4-12(5-7-13)16-24-17(19(20,21)22)25-26(16)14-8-10-15(11-9-14)29(23,27)28/h4-11H,1-3H3,(H2,23,27,28)