5-[4-(furan-2-yl)-3-methyl-phenyl]-1-(4-methylsulfonylphenyl)-3-(trifluoromethyl)pyrazole

Systemtic Name: 5-[4-(furan-2-yl)-3-methyl-phenyl]-1-(4-methylsulfonylphenyl)-3-(trifluoromethyl)pyrazole Openeye Name: 5-[4-(2-furyl)-3-methyl-phenyl]-1-(4-methylsulfonylphenyl)-3-(trifluoromethyl)pyrazole CAS Name: 5-[4-(2-furanyl)-3-methylphenyl]-1-(4-methylsulfonylphenyl)-3-(trifluoromethyl)pyrazole IUPAC Name: 5-[4-(furan-2-yl)-3-methylphenyl]-1-(4-methylsulfonylphenyl)-3-(trifluoromethyl)pyrazole Traditional Name: 5-[4-(2-furyl)-3-methyl-phenyl]-1-(4-mesylphenyl)-3-(trifluoromethyl)pyrazole Formula: C22H17F3N2O3S MolecularWeight: 446.44219

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=CC(=NN2C3=CC=C(C=C3)S(=O)(=O)C)C(F)(F)F)C4=CC=CO4

Isomeric SMILES

CC1=C(C=CC(=C1)C2=CC(=NN2C3=CC=C(C=C3)S(=O)(=O)C)C(F)(F)F)C4=CC=CO4

InChI

InChI=1S/C22H17F3N2O3S/c1-14-12-15(5-10-18(14)20-4-3-11-30-20)19-13-21(22(23,24)25)26-27(19)16-6-8-17(9-7-16)31(2,28)29/h3-13H,1-2H3