N-[5-(2,4-dimethylphenyl)-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide

Systemtic Name: N-[5-(2,4-dimethylphenyl)-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide Openeye Name: N-[5-(2,4-dimethylphenyl)-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide CAS Name: N-[5-(2,4-dimethylphenyl)-3-(trifluoromethyl)-1-pyrazolyl]benzenesulfonamide IUPAC Name: N-[5-(2,4-dimethylphenyl)-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide Traditional Name: N-[5-(2,4-dimethylphenyl)-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide Formula: C18H16F3N3O2S MolecularWeight: 395.39875

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=CC(=NN2NS(=O)(=O)C3=CC=CC=C3)C(F)(F)F)C

Isomeric SMILES

CC1=CC(=C(C=C1)C2=CC(=NN2NS(=O)(=O)C3=CC=CC=C3)C(F)(F)F)C

InChI

InChI=1S/C18H16F3N3O2S/c1-12-8-9-15(13(2)10-12)16-11-17(18(19,20)21)22-24(16)23-27(25,26)14-6-4-3-5-7-14/h3-11,23H,1-2H3