4-[4-(4-methoxy-3-methyl-phenyl)-3-(trifluoromethyl)-1,5-dihydropyrazol-4-yl]benzenesulfonamide

Systemtic Name: 4-[4-(4-methoxy-3-methyl-phenyl)-3-(trifluoromethyl)-1,5-dihydropyrazol-4-yl]benzenesulfonamide Openeye Name: 4-[4-(4-methoxy-3-methyl-phenyl)-3-(trifluoromethyl)-1,5-dihydropyrazol-4-yl]benzenesulfonamide CAS Name: 4-[4-(4-methoxy-3-methylphenyl)-3-(trifluoromethyl)-1,5-dihydropyrazol-4-yl]benzenesulfonamide IUPAC Name: 4-[4-(4-methoxy-3-methylphenyl)-3-(trifluoromethyl)-1,5-dihydropyrazol-4-yl]benzenesulfonamide Traditional Name: 4-[4-(4-methoxy-3-methyl-phenyl)-3-(trifluoromethyl)-2-pyrazolin-4-yl]benzenesulfonamide Formula: C18H18F3N3O3S MolecularWeight: 413.41403

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2(CNN=C2C(F)(F)F)C3=CC=C(C=C3)S(=O)(=O)N)OC

Isomeric SMILES

CC1=C(C=CC(=C1)C2(CNN=C2C(F)(F)F)C3=CC=C(C=C3)S(=O)(=O)N)OC

InChI

InChI=1S/C18H18F3N3O3S/c1-11-9-13(5-8-15(11)27-2)17(10-23-24-16(17)18(19,20)21)12-3-6-14(7-4-12)28(22,25)26/h3-9,23H,10H2,1-2H3,(H2,22,25,26)