S-(4-chlorophenyl) 1-phenyl-5-(trifluoromethyl)pyrazole-4-carbothioate

Systemtic Name: S-(4-chlorophenyl) 1-phenyl-5-(trifluoromethyl)pyrazole-4-carbothioate Openeye Name: S-(4-chlorophenyl) 1-phenyl-5-(trifluoromethyl)pyrazole-4-carbothioate CAS Name: 1-phenyl-5-(trifluoromethyl)-4-pyrazolecarbothioic acid S-(4-chlorophenyl) ester IUPAC Name: S-(4-chlorophenyl) 1-phenyl-5-(trifluoromethyl)pyrazole-4-carbothioate Traditional Name: 1-phenyl-5-(trifluoromethyl)pyrazole-4-carbothioic acid S-(4-chlorophenyl) ester Formula: C17H10ClF3N2OS MolecularWeight: 382.78731

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=C(C=N2)C(=O)SC3=CC=C(C=C3)Cl)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)N2C(=C(C=N2)C(=O)SC3=CC=C(C=C3)Cl)C(F)(F)F

InChI

InChI=1S/C17H10ClF3N2OS/c18-11-6-8-13(9-7-11)25-16(24)14-10-22-23(15(14)17(19,20)21)12-4-2-1-3-5-12/h1-10H