4-(3-fluoranyl-4-methoxy-phenyl)-3-(4-methylsulfonylphenyl)-1-(trifluoromethyl)pyrazole

Systemtic Name: 4-(3-fluoranyl-4-methoxy-phenyl)-3-(4-methylsulfonylphenyl)-1-(trifluoromethyl)pyrazole Openeye Name: 4-(3-fluoro-4-methoxy-phenyl)-3-(4-methylsulfonylphenyl)-1-(trifluoromethyl)pyrazole CAS Name: 4-(3-fluoro-4-methoxyphenyl)-3-(4-methylsulfonylphenyl)-1-(trifluoromethyl)pyrazole IUPAC Name: 4-(3-fluoro-4-methoxyphenyl)-3-(4-methylsulfonylphenyl)-1-(trifluoromethyl)pyrazole Traditional Name: 4-(3-fluoro-4-methoxy-phenyl)-3-(4-mesylphenyl)-1-(trifluoromethyl)pyrazole Formula: C18H14F4N2O3S MolecularWeight: 414.373973

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CN(N=C2C3=CC=C(C=C3)S(=O)(=O)C)C(F)(F)F)F

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CN(N=C2C3=CC=C(C=C3)S(=O)(=O)C)C(F)(F)F)F

InChI

InChI=1S/C18H14F4N2O3S/c1-27-16-8-5-12(9-15(16)19)14-10-24(18(20,21)22)23-17(14)11-3-6-13(7-4-11)28(2,25)26/h3-10H,1-2H3