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

Systemtic Name: 5-[4-(furan-2-yl)-3-methoxy-phenyl]-1-(4-methylsulfonylphenyl)-3-(trifluoromethyl)pyrazole Openeye Name: 5-[4-(2-furyl)-3-methoxy-phenyl]-1-(4-methylsulfonylphenyl)-3-(trifluoromethyl)pyrazole CAS Name: 5-[4-(2-furanyl)-3-methoxyphenyl]-1-(4-methylsulfonylphenyl)-3-(trifluoromethyl)pyrazole IUPAC Name: 5-[4-(furan-2-yl)-3-methoxyphenyl]-1-(4-methylsulfonylphenyl)-3-(trifluoromethyl)pyrazole Traditional Name: 5-[4-(2-furyl)-3-methoxy-phenyl]-1-(4-mesylphenyl)-3-(trifluoromethyl)pyrazole Formula: C22H17F3N2O4S MolecularWeight: 462.44159

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2=CC(=NN2C3=CC=C(C=C3)S(=O)(=O)C)C(F)(F)F)C4=CC=CO4

Isomeric SMILES

COC1=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/C22H17F3N2O4S/c1-30-20-12-14(5-10-17(20)19-4-3-11-31-19)18-13-21(22(23,24)25)26-27(18)15-6-8-16(9-7-15)32(2,28)29/h3-13H,1-2H3