1-(3-fluoranyl-4-methylsulfonyl-phenyl)-5-(4-thiophen-3-ylphenyl)-3-(trifluoromethyl)pyrazole

Systemtic Name: 1-(3-fluoranyl-4-methylsulfonyl-phenyl)-5-(4-thiophen-3-ylphenyl)-3-(trifluoromethyl)pyrazole Openeye Name: 1-(3-fluoro-4-methylsulfonyl-phenyl)-5-[4-(3-thienyl)phenyl]-3-(trifluoromethyl)pyrazole CAS Name: 1-(3-fluoro-4-methylsulfonylphenyl)-5-[4-(3-thiophenyl)phenyl]-3-(trifluoromethyl)pyrazole IUPAC Name: 1-(3-fluoro-4-methylsulfonylphenyl)-5-(4-thiophen-3-ylphenyl)-3-(trifluoromethyl)pyrazole Traditional Name: 1-(3-fluoro-4-mesyl-phenyl)-5-[4-(3-thienyl)phenyl]-3-(trifluoromethyl)pyrazole Formula: C21H14F4N2O2S2 MolecularWeight: 466.471673

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H14F4N2O2S2/c1-31(28,29)19-7-6-16(10-17(19)22)27-18(11-20(26-27)21(23,24)25)14-4-2-13(3-5-14)15-8-9-30-12-15/h2-12H,1H3