2-(2-methylphenyl)-3-(4-methylsulfonylphenyl)-5-(trifluoromethyl)-3,4-dihydropyrazole

Systemtic Name: 2-(2-methylphenyl)-3-(4-methylsulfonylphenyl)-5-(trifluoromethyl)-3,4-dihydropyrazole Openeye Name: 3-(4-methylsulfonylphenyl)-2-(o-tolyl)-5-(trifluoromethyl)-3,4-dihydropyrazole CAS Name: 2-(2-methylphenyl)-3-(4-methylsulfonylphenyl)-5-(trifluoromethyl)-3,4-dihydropyrazole IUPAC Name: 2-(2-methylphenyl)-3-(4-methylsulfonylphenyl)-5-(trifluoromethyl)-3,4-dihydropyrazole Traditional Name: 5-(4-mesylphenyl)-1-(o-tolyl)-3-(trifluoromethyl)-2-pyrazoline Formula: C18H17F3N2O2S MolecularWeight: 382.39999

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(CC(=N2)C(F)(F)F)C3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CC1=CC=CC=C1N2C(CC(=N2)C(F)(F)F)C3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C18H17F3N2O2S/c1-12-5-3-4-6-15(12)23-16(11-17(22-23)18(19,20)21)13-7-9-14(10-8-13)26(2,24)25/h3-10,16H,11H2,1-2H3