S-[(2-chloranyl-6-fluoranyl-phenyl)methyl] 1-(4-chlorophenyl)-5-propyl-pyrazole-4-carbothioate

Systemtic Name: S-[(2-chloranyl-6-fluoranyl-phenyl)methyl] 1-(4-chlorophenyl)-5-propyl-pyrazole-4-carbothioate Openeye Name: S-[(2-chloro-6-fluoro-phenyl)methyl] 1-(4-chlorophenyl)-5-propyl-pyrazole-4-carbothioate CAS Name: 1-(4-chlorophenyl)-5-propyl-4-pyrazolecarbothioic acid S-[(2-chloro-6-fluorophenyl)methyl] ester IUPAC Name: S-[(2-chloro-6-fluorophenyl)methyl] 1-(4-chlorophenyl)-5-propylpyrazole-4-carbothioate Traditional Name: 1-(4-chlorophenyl)-5-propyl-pyrazole-4-carbothioic acid S-(2-chloro-6-fluoro-benzyl) ester Formula: C20H17Cl2FN2OS MolecularWeight: 423.331183

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=NN1C2=CC=C(C=C2)Cl)C(=O)SCC3=C(C=CC=C3Cl)F

Isomeric SMILES

CCCC1=C(C=NN1C2=CC=C(C=C2)Cl)C(=O)SCC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C20H17Cl2FN2OS/c1-2-4-19-15(11-24-25(19)14-9-7-13(21)8-10-14)20(26)27-12-16-17(22)5-3-6-18(16)23/h3,5-11H,2,4,12H2,1H3