5-[bis(fluoranyl)methyl]-4-(4-methylphenyl)-3-(4-methylsulfonylphenyl)-1H-pyrazole

Systemtic Name: 5-[bis(fluoranyl)methyl]-4-(4-methylphenyl)-3-(4-methylsulfonylphenyl)-1H-pyrazole Openeye Name: 5-(difluoromethyl)-3-(4-methylsulfonylphenyl)-4-(p-tolyl)-1H-pyrazole CAS Name: 5-(difluoromethyl)-4-(4-methylphenyl)-3-(4-methylsulfonylphenyl)-1H-pyrazole IUPAC Name: 5-(difluoromethyl)-4-(4-methylphenyl)-3-(4-methylsulfonylphenyl)-1H-pyrazole Traditional Name: 5-(difluoromethyl)-3-(4-mesylphenyl)-4-(p-tolyl)-1H-pyrazole Formula: C18H16F2N2O2S MolecularWeight: 362.393646

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(NN=C2C3=CC=C(C=C3)S(=O)(=O)C)C(F)F

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(NN=C2C3=CC=C(C=C3)S(=O)(=O)C)C(F)F

InChI

InChI=1S/C18H16F2N2O2S/c1-11-3-5-12(6-4-11)15-16(21-22-17(15)18(19)20)13-7-9-14(10-8-13)25(2,23)24/h3-10,18H,1-2H3,(H,21,22)