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

Systemtic Name: 4-[5-(4-ethoxyphenyl)-3-(trifluoromethyl)-1,2,4-triazol-1-yl]benzenesulfonamide Openeye Name: 4-[5-(4-ethoxyphenyl)-3-(trifluoromethyl)-1,2,4-triazol-1-yl]benzenesulfonamide CAS Name: 4-[5-(4-ethoxyphenyl)-3-(trifluoromethyl)-1,2,4-triazol-1-yl]benzenesulfonamide IUPAC Name: 4-[5-(4-ethoxyphenyl)-3-(trifluoromethyl)-1,2,4-triazol-1-yl]benzenesulfonamide Traditional Name: 4-[5-p-phenetyl-3-(trifluoromethyl)-1,2,4-triazol-1-yl]benzenesulfonamide Formula: C17H15F3N4O3S MolecularWeight: 412.38621

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NC(=NN2C3=CC=C(C=C3)S(=O)(=O)N)C(F)(F)F

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NC(=NN2C3=CC=C(C=C3)S(=O)(=O)N)C(F)(F)F

InChI

InChI=1S/C17H15F3N4O3S/c1-2-27-13-7-3-11(4-8-13)15-22-16(17(18,19)20)23-24(15)12-5-9-14(10-6-12)28(21,25)26/h3-10H,2H2,1H3,(H2,21,25,26)