3-[bis(fluoranyl)methyl]-5-(4-methylsulfonylphenyl)-4-(4-methylthiophen-2-yl)-1-phenyl-pyrazole

Systemtic Name: 3-[bis(fluoranyl)methyl]-5-(4-methylsulfonylphenyl)-4-(4-methylthiophen-2-yl)-1-phenyl-pyrazole Openeye Name: 3-(difluoromethyl)-5-(4-methylsulfonylphenyl)-4-(4-methyl-2-thienyl)-1-phenyl-pyrazole CAS Name: 3-(difluoromethyl)-5-(4-methylsulfonylphenyl)-4-(4-methyl-2-thiophenyl)-1-phenylpyrazole IUPAC Name: 3-(difluoromethyl)-5-(4-methylsulfonylphenyl)-4-(4-methylthiophen-2-yl)-1-phenylpyrazole Traditional Name: 3-(difluoromethyl)-5-(4-mesylphenyl)-4-(4-methyl-2-thienyl)-1-phenyl-pyrazole Formula: C22H18F2N2O2S2 MolecularWeight: 444.517326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=C1)C2=C(N(N=C2C(F)F)C3=CC=CC=C3)C4=CC=C(C=C4)S(=O)(=O)C

Isomeric SMILES

CC1=CSC(=C1)C2=C(N(N=C2C(F)F)C3=CC=CC=C3)C4=CC=C(C=C4)S(=O)(=O)C

InChI

InChI=1S/C22H18F2N2O2S2/c1-14-12-18(29-13-14)19-20(22(23)24)25-26(16-6-4-3-5-7-16)21(19)15-8-10-17(11-9-15)30(2,27)28/h3-13,22H,1-2H3