1-(4-chlorophenyl)-N-(2-phenylsulfanylethyl)-5-(trifluoromethyl)pyrazole-4-carboxamide

Systemtic Name: 1-(4-chlorophenyl)-N-(2-phenylsulfanylethyl)-5-(trifluoromethyl)pyrazole-4-carboxamide Openeye Name: 1-(4-chlorophenyl)-N-(2-phenylsulfanylethyl)-5-(trifluoromethyl)pyrazole-4-carboxamide CAS Name: 1-(4-chlorophenyl)-N-[2-(phenylthio)ethyl]-5-(trifluoromethyl)-4-pyrazolecarboxamide IUPAC Name: 1-(4-chlorophenyl)-N-(2-phenylsulfanylethyl)-5-(trifluoromethyl)pyrazole-4-carboxamide Traditional Name: 1-(4-chlorophenyl)-N-[2-(phenylthio)ethyl]-5-(trifluoromethyl)pyrazole-4-carboxamide Formula: C19H15ClF3N3OS MolecularWeight: 425.85511

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCCNC(=O)C2=C(N(N=C2)C3=CC=C(C=C3)Cl)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)SCCNC(=O)C2=C(N(N=C2)C3=CC=C(C=C3)Cl)C(F)(F)F

InChI

InChI=1S/C19H15ClF3N3OS/c20-13-6-8-14(9-7-13)26-17(19(21,22)23)16(12-25-26)18(27)24-10-11-28-15-4-2-1-3-5-15/h1-9,12H,10-11H2,(H,24,27)