1-ethyl-3-(4-methylsulfonylphenyl)-4-thiophen-2-yl-5-(trifluoromethyl)pyrazole

Systemtic Name: 1-ethyl-3-(4-methylsulfonylphenyl)-4-thiophen-2-yl-5-(trifluoromethyl)pyrazole Openeye Name: 1-ethyl-3-(4-methylsulfonylphenyl)-4-(2-thienyl)-5-(trifluoromethyl)pyrazole CAS Name: 1-ethyl-3-(4-methylsulfonylphenyl)-4-thiophen-2-yl-5-(trifluoromethyl)pyrazole IUPAC Name: 1-ethyl-3-(4-methylsulfonylphenyl)-4-thiophen-2-yl-5-(trifluoromethyl)pyrazole Traditional Name: 1-ethyl-3-(4-mesylphenyl)-4-(2-thienyl)-5-(trifluoromethyl)pyrazole Formula: C17H15F3N2O2S2 MolecularWeight: 400.43841

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=N1)C2=CC=C(C=C2)S(=O)(=O)C)C3=CC=CS3)C(F)(F)F

Isomeric SMILES

CCN1C(=C(C(=N1)C2=CC=C(C=C2)S(=O)(=O)C)C3=CC=CS3)C(F)(F)F

InChI

InChI=1S/C17H15F3N2O2S2/c1-3-22-16(17(18,19)20)14(13-5-4-10-25-13)15(21-22)11-6-8-12(9-7-11)26(2,23)24/h4-10H,3H2,1-2H3