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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)N2C=C(C(=N2)C(F)(F)F)C3=CC=C(C=C3)C4=CC=CO4)S(=O)(=O)C

Isomeric SMILES

COC1=C(C=CC(=C1)N2C=C(C(=N2)C(F)(F)F)C3=CC=C(C=C3)C4=CC=CO4)S(=O)(=O)C

InChI

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