4-[3-(4-thiophen-2-ylphenyl)-4-(trifluoromethyl)-1H-pyrazol-5-yl]benzenesulfonamide

Systemtic Name: 4-[3-(4-thiophen-2-ylphenyl)-4-(trifluoromethyl)-1H-pyrazol-5-yl]benzenesulfonamide Openeye Name: 4-[3-[4-(2-thienyl)phenyl]-4-(trifluoromethyl)-1H-pyrazol-5-yl]benzenesulfonamide CAS Name: 4-[3-(4-thiophen-2-ylphenyl)-4-(trifluoromethyl)-1H-pyrazol-5-yl]benzenesulfonamide IUPAC Name: 4-[3-(4-thiophen-2-ylphenyl)-4-(trifluoromethyl)-1H-pyrazol-5-yl]benzenesulfonamide Traditional Name: 4-[3-[4-(2-thienyl)phenyl]-4-(trifluoromethyl)-1H-pyrazol-5-yl]benzenesulfonamide Formula: C20H14F3N3O2S2 MolecularWeight: 449.46927

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=CC=C(C=C2)C3=NNC(=C3C(F)(F)F)C4=CC=C(C=C4)S(=O)(=O)N

Isomeric SMILES

C1=CSC(=C1)C2=CC=C(C=C2)C3=NNC(=C3C(F)(F)F)C4=CC=C(C=C4)S(=O)(=O)N

InChI

InChI=1S/C20H14F3N3O2S2/c21-20(22,23)17-18(13-5-3-12(4-6-13)16-2-1-11-29-16)25-26-19(17)14-7-9-15(10-8-14)30(24,27)28/h1-11H,(H,25,26)(H2,24,27,28)