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

Systemtic Name: 4-[5-(3-methoxyphenyl)-3-(trifluoromethyl)-1,2,4-triazol-1-yl]benzenesulfonamide Openeye Name: 4-[5-(3-methoxyphenyl)-3-(trifluoromethyl)-1,2,4-triazol-1-yl]benzenesulfonamide CAS Name: 4-[5-(3-methoxyphenyl)-3-(trifluoromethyl)-1,2,4-triazol-1-yl]benzenesulfonamide IUPAC Name: 4-[5-(3-methoxyphenyl)-3-(trifluoromethyl)-1,2,4-triazol-1-yl]benzenesulfonamide Traditional Name: 4-[5-(3-methoxyphenyl)-3-(trifluoromethyl)-1,2,4-triazol-1-yl]benzenesulfonamide Formula: C16H13F3N4O3S MolecularWeight: 398.35963

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NC(=NN2C3=CC=C(C=C3)S(=O)(=O)N)C(F)(F)F

Isomeric SMILES

COC1=CC=CC(=C1)C2=NC(=NN2C3=CC=C(C=C3)S(=O)(=O)N)C(F)(F)F

InChI

InChI=1S/C16H13F3N4O3S/c1-26-12-4-2-3-10(9-12)14-21-15(16(17,18)19)22-23(14)11-5-7-13(8-6-11)27(20,24)25/h2-9H,1H3,(H2,20,24,25)