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

Systemtic Name: S-(4-chlorophenyl) 1-(4-chlorophenyl)-5-(trifluoromethyl)pyrazole-4-carbothioate Openeye Name: S-(4-chlorophenyl) 1-(4-chlorophenyl)-5-(trifluoromethyl)pyrazole-4-carbothioate CAS Name: 1-(4-chlorophenyl)-5-(trifluoromethyl)-4-pyrazolecarbothioic acid S-(4-chlorophenyl) ester IUPAC Name: S-(4-chlorophenyl) 1-(4-chlorophenyl)-5-(trifluoromethyl)pyrazole-4-carbothioate Traditional Name: 1-(4-chlorophenyl)-5-(trifluoromethyl)pyrazole-4-carbothioic acid S-(4-chlorophenyl) ester Formula: C17H9Cl2F3N2OS MolecularWeight: 417.23237

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N2C(=C(C=N2)C(=O)SC3=CC=C(C=C3)Cl)C(F)(F)F)Cl

Isomeric SMILES

C1=CC(=CC=C1N2C(=C(C=N2)C(=O)SC3=CC=C(C=C3)Cl)C(F)(F)F)Cl

InChI

InChI=1S/C17H9Cl2F3N2OS/c18-10-1-5-12(6-2-10)24-15(17(20,21)22)14(9-23-24)16(25)26-13-7-3-11(19)4-8-13/h1-9H