5-[(2-chlorophenyl)methylsulfanyl]-N-(4-methoxyphenyl)-1-methyl-3-(trifluoromethyl)pyrazole-4-carboxamide

Systemtic Name: 5-[(2-chlorophenyl)methylsulfanyl]-N-(4-methoxyphenyl)-1-methyl-3-(trifluoromethyl)pyrazole-4-carboxamide Openeye Name: 5-[(2-chlorophenyl)methylsulfanyl]-N-(4-methoxyphenyl)-1-methyl-3-(trifluoromethyl)pyrazole-4-carboxamide CAS Name: 5-[(2-chlorophenyl)methylthio]-N-(4-methoxyphenyl)-1-methyl-3-(trifluoromethyl)-4-pyrazolecarboxamide IUPAC Name: 5-[(2-chlorophenyl)methylsulfanyl]-N-(4-methoxyphenyl)-1-methyl-3-(trifluoromethyl)pyrazole-4-carboxamide Traditional Name: 5-[(2-chlorobenzyl)thio]-N-(4-methoxyphenyl)-1-methyl-3-(trifluoromethyl)pyrazole-4-carboxamide Formula: C20H17ClF3N3O2S MolecularWeight: 455.88109

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=N1)C(F)(F)F)C(=O)NC2=CC=C(C=C2)OC)SCC3=CC=CC=C3Cl

Isomeric SMILES

CN1C(=C(C(=N1)C(F)(F)F)C(=O)NC2=CC=C(C=C2)OC)SCC3=CC=CC=C3Cl

InChI

InChI=1S/C20H17ClF3N3O2S/c1-27-19(30-11-12-5-3-4-6-15(12)21)16(17(26-27)20(22,23)24)18(28)25-13-7-9-14(29-2)10-8-13/h3-10H,11H2,1-2H3,(H,25,28)