1-[4-[5-(4-methylphenyl)sulfonyl-3-(trifluoromethyl)pyrazol-1-yl]phenyl]ethanone

Systemtic Name: 1-[4-[5-(4-methylphenyl)sulfonyl-3-(trifluoromethyl)pyrazol-1-yl]phenyl]ethanone Openeye Name: 1-[4-[5-(p-tolylsulfonyl)-3-(trifluoromethyl)pyrazol-1-yl]phenyl]ethanone CAS Name: 1-[4-[5-(4-methylphenyl)sulfonyl-3-(trifluoromethyl)-1-pyrazolyl]phenyl]ethanone IUPAC Name: 1-[4-[5-(4-methylphenyl)sulfonyl-3-(trifluoromethyl)pyrazol-1-yl]phenyl]ethanone Traditional Name: 1-[4-[5-tosyl-3-(trifluoromethyl)pyrazol-1-yl]phenyl]ethanone Formula: C19H15F3N2O3S MolecularWeight: 408.39421

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=CC(=NN2C3=CC=C(C=C3)C(=O)C)C(F)(F)F

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=CC(=NN2C3=CC=C(C=C3)C(=O)C)C(F)(F)F

InChI

InChI=1S/C19H15F3N2O3S/c1-12-3-9-16(10-4-12)28(26,27)18-11-17(19(20,21)22)23-24(18)15-7-5-14(6-8-15)13(2)25/h3-11H,1-2H3