1-(4-chlorophenyl)-N-(3-methylsulfanylphenyl)-5-(trifluoromethyl)pyrazole-4-carboxamide

Systemtic Name: 1-(4-chlorophenyl)-N-(3-methylsulfanylphenyl)-5-(trifluoromethyl)pyrazole-4-carboxamide Openeye Name: 1-(4-chlorophenyl)-N-(3-methylsulfanylphenyl)-5-(trifluoromethyl)pyrazole-4-carboxamide CAS Name: 1-(4-chlorophenyl)-N-[3-(methylthio)phenyl]-5-(trifluoromethyl)-4-pyrazolecarboxamide IUPAC Name: 1-(4-chlorophenyl)-N-(3-methylsulfanylphenyl)-5-(trifluoromethyl)pyrazole-4-carboxamide Traditional Name: 1-(4-chlorophenyl)-N-[3-(methylthio)phenyl]-5-(trifluoromethyl)pyrazole-4-carboxamide Formula: C18H13ClF3N3OS MolecularWeight: 411.82853

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)NC(=O)C2=C(N(N=C2)C3=CC=C(C=C3)Cl)C(F)(F)F

Isomeric SMILES

CSC1=CC=CC(=C1)NC(=O)C2=C(N(N=C2)C3=CC=C(C=C3)Cl)C(F)(F)F

InChI

InChI=1S/C18H13ClF3N3OS/c1-27-14-4-2-3-12(9-14)24-17(26)15-10-23-25(16(15)18(20,21)22)13-7-5-11(19)6-8-13/h2-10H,1H3,(H,24,26)