4-[5-methyl-5-(4-methylphenyl)-3-(trifluoromethyl)-4H-pyrazol-1-yl]benzenesulfonamide

Systemtic Name: 4-[5-methyl-5-(4-methylphenyl)-3-(trifluoromethyl)-4H-pyrazol-1-yl]benzenesulfonamide Openeye Name: 4-[5-methyl-5-(p-tolyl)-3-(trifluoromethyl)-4H-pyrazol-1-yl]benzenesulfonamide CAS Name: 4-[5-methyl-5-(4-methylphenyl)-3-(trifluoromethyl)-4H-pyrazol-1-yl]benzenesulfonamide IUPAC Name: 4-[5-methyl-5-(4-methylphenyl)-3-(trifluoromethyl)-4H-pyrazol-1-yl]benzenesulfonamide Traditional Name: 4-[5-methyl-5-(p-tolyl)-3-(trifluoromethyl)-2-pyrazolin-1-yl]benzenesulfonamide Formula: C18H18F3N3O2S MolecularWeight: 397.41463

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2(CC(=NN2C3=CC=C(C=C3)S(=O)(=O)N)C(F)(F)F)C

Isomeric SMILES

CC1=CC=C(C=C1)C2(CC(=NN2C3=CC=C(C=C3)S(=O)(=O)N)C(F)(F)F)C

InChI

InChI=1S/C18H18F3N3O2S/c1-12-3-5-13(6-4-12)17(2)11-16(18(19,20)21)23-24(17)14-7-9-15(10-8-14)27(22,25)26/h3-10H,11H2,1-2H3,(H2,22,25,26)