3-[bis(fluoranyl)methyl]-1-(3-bromanyl-4-methyl-phenyl)-5-(4-methylsulfonylphenyl)pyrazole

Systemtic Name: 3-[bis(fluoranyl)methyl]-1-(3-bromanyl-4-methyl-phenyl)-5-(4-methylsulfonylphenyl)pyrazole Openeye Name: 1-(3-bromo-4-methyl-phenyl)-3-(difluoromethyl)-5-(4-methylsulfonylphenyl)pyrazole CAS Name: 1-(3-bromo-4-methylphenyl)-3-(difluoromethyl)-5-(4-methylsulfonylphenyl)pyrazole IUPAC Name: 1-(3-bromo-4-methylphenyl)-3-(difluoromethyl)-5-(4-methylsulfonylphenyl)pyrazole Traditional Name: 1-(3-bromo-4-methyl-phenyl)-3-(difluoromethyl)-5-(4-mesylphenyl)pyrazole Formula: C18H15BrF2N2O2S MolecularWeight: 441.289706

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H15BrF2N2O2S/c1-11-3-6-13(9-15(11)19)23-17(10-16(22-23)18(20)21)12-4-7-14(8-5-12)26(2,24)25/h3-10,18H,1-2H3