S-[2,4,6-tris(chloranyl)phenyl] 4-bromanyl-2-ethyl-5-methyl-pyrazole-3-carbothioate

Systemtic Name: S-[2,4,6-tris(chloranyl)phenyl] 4-bromanyl-2-ethyl-5-methyl-pyrazole-3-carbothioate Openeye Name: S-(2,4,6-trichlorophenyl) 4-bromo-2-ethyl-5-methyl-pyrazole-3-carbothioate CAS Name: 4-bromo-2-ethyl-5-methyl-3-pyrazolecarbothioic acid S-(2,4,6-trichlorophenyl) ester IUPAC Name: S-(2,4,6-trichlorophenyl) 4-bromo-2-ethyl-5-methylpyrazole-3-carbothioate Traditional Name: 4-bromo-2-ethyl-5-methyl-pyrazole-3-carbothioic acid S-(2,4,6-trichlorophenyl) ester Formula: C13H10BrCl3N2OS MolecularWeight: 428.5593

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=N1)C)Br)C(=O)SC2=C(C=C(C=C2Cl)Cl)Cl

Isomeric SMILES

CCN1C(=C(C(=N1)C)Br)C(=O)SC2=C(C=C(C=C2Cl)Cl)Cl

InChI

InChI=1S/C13H10BrCl3N2OS/c1-3-19-11(10(14)6(2)18-19)13(20)21-12-8(16)4-7(15)5-9(12)17/h4-5H,3H2,1-2H3