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

Systemtic Name: 4-[3-(furan-3-yl)phenyl]-1-(4-methylsulfonylphenyl)-3-(trifluoromethyl)pyrazole Openeye Name: 4-[3-(3-furyl)phenyl]-1-(4-methylsulfonylphenyl)-3-(trifluoromethyl)pyrazole CAS Name: 4-[3-(3-furanyl)phenyl]-1-(4-methylsulfonylphenyl)-3-(trifluoromethyl)pyrazole IUPAC Name: 4-[3-(furan-3-yl)phenyl]-1-(4-methylsulfonylphenyl)-3-(trifluoromethyl)pyrazole Traditional Name: 4-[3-(3-furyl)phenyl]-1-(4-mesylphenyl)-3-(trifluoromethyl)pyrazole Formula: C21H15F3N2O3S MolecularWeight: 432.41561

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)N2C=C(C(=N2)C(F)(F)F)C3=CC=CC(=C3)C4=COC=C4

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)N2C=C(C(=N2)C(F)(F)F)C3=CC=CC(=C3)C4=COC=C4

InChI

InChI=1S/C21H15F3N2O3S/c1-30(27,28)18-7-5-17(6-8-18)26-12-19(20(25-26)21(22,23)24)15-4-2-3-14(11-15)16-9-10-29-13-16/h2-13H,1H3