1-(3-fluoranyl-4-methyl-phenyl)-5-(4-methylsulfonylphenyl)-3-(trifluoromethyl)pyrazole

Systemtic Name: 1-(3-fluoranyl-4-methyl-phenyl)-5-(4-methylsulfonylphenyl)-3-(trifluoromethyl)pyrazole Openeye Name: 1-(3-fluoro-4-methyl-phenyl)-5-(4-methylsulfonylphenyl)-3-(trifluoromethyl)pyrazole CAS Name: 1-(3-fluoro-4-methylphenyl)-5-(4-methylsulfonylphenyl)-3-(trifluoromethyl)pyrazole IUPAC Name: 1-(3-fluoro-4-methylphenyl)-5-(4-methylsulfonylphenyl)-3-(trifluoromethyl)pyrazole Traditional Name: 1-(3-fluoro-4-methyl-phenyl)-5-(4-mesylphenyl)-3-(trifluoromethyl)pyrazole Formula: C18H14F4N2O2S MolecularWeight: 398.374573

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=CC(=N2)C(F)(F)F)C3=CC=C(C=C3)S(=O)(=O)C)F

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=CC(=N2)C(F)(F)F)C3=CC=C(C=C3)S(=O)(=O)C)F

InChI

InChI=1S/C18H14F4N2O2S/c1-11-3-6-13(9-15(11)19)24-16(10-17(23-24)18(20,21)22)12-4-7-14(8-5-12)27(2,25)26/h3-10H,1-2H3