1-(3-chloranyl-4-propan-2-yl-phenyl)-5-(4-methylsulfonylphenyl)-3-(trifluoromethyl)pyrazole

Systemtic Name: 1-(3-chloranyl-4-propan-2-yl-phenyl)-5-(4-methylsulfonylphenyl)-3-(trifluoromethyl)pyrazole Openeye Name: 1-(3-chloro-4-isopropyl-phenyl)-5-(4-methylsulfonylphenyl)-3-(trifluoromethyl)pyrazole CAS Name: 1-(3-chloro-4-propan-2-ylphenyl)-5-(4-methylsulfonylphenyl)-3-(trifluoromethyl)pyrazole IUPAC Name: 1-(3-chloro-4-propan-2-ylphenyl)-5-(4-methylsulfonylphenyl)-3-(trifluoromethyl)pyrazole Traditional Name: 1-(3-chloro-4-isopropyl-phenyl)-5-(4-mesylphenyl)-3-(trifluoromethyl)pyrazole Formula: C20H18ClF3N2O2S MolecularWeight: 442.88233

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H18ClF3N2O2S/c1-12(2)16-9-6-14(10-17(16)21)26-18(11-19(25-26)20(22,23)24)13-4-7-15(8-5-13)29(3,27)28/h4-12H,1-3H3