2-(4-chloranyl-2-methyl-phenyl)-3-(4-methylsulfonylphenyl)-5-(trifluoromethyl)-3,4-dihydropyrazole

Systemtic Name: 2-(4-chloranyl-2-methyl-phenyl)-3-(4-methylsulfonylphenyl)-5-(trifluoromethyl)-3,4-dihydropyrazole Openeye Name: 2-(4-chloro-2-methyl-phenyl)-3-(4-methylsulfonylphenyl)-5-(trifluoromethyl)-3,4-dihydropyrazole CAS Name: 2-(4-chloro-2-methylphenyl)-3-(4-methylsulfonylphenyl)-5-(trifluoromethyl)-3,4-dihydropyrazole IUPAC Name: 2-(4-chloro-2-methylphenyl)-3-(4-methylsulfonylphenyl)-5-(trifluoromethyl)-3,4-dihydropyrazole Traditional Name: 1-(4-chloro-2-methyl-phenyl)-5-(4-mesylphenyl)-3-(trifluoromethyl)-2-pyrazoline Formula: C18H16ClF3N2O2S MolecularWeight: 416.84505

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H16ClF3N2O2S/c1-11-9-13(19)5-8-15(11)24-16(10-17(23-24)18(20,21)22)12-3-6-14(7-4-12)27(2,25)26/h3-9,16H,10H2,1-2H3