[2-tert-butyl-4-(4-chlorophenyl)sulfanyl-5-methyl-pyrazol-3-yl] 2,4-bis(chloranyl)benzoate

Systemtic Name: [2-tert-butyl-4-(4-chlorophenyl)sulfanyl-5-methyl-pyrazol-3-yl] 2,4-bis(chloranyl)benzoate Openeye Name: [2-tert-butyl-4-(4-chlorophenyl)sulfanyl-5-methyl-pyrazol-3-yl] 2,4-dichlorobenzoate CAS Name: 2,4-dichlorobenzoic acid [2-tert-butyl-4-[(4-chlorophenyl)thio]-5-methyl-3-pyrazolyl] ester IUPAC Name: [2-tert-butyl-4-(4-chlorophenyl)sulfanyl-5-methylpyrazol-3-yl] 2,4-dichlorobenzoate Traditional Name: 2,4-dichlorobenzoic acid [2-tert-butyl-4-[(4-chlorophenyl)thio]-5-methyl-pyrazol-3-yl] ester Formula: C21H19Cl3N2O2S MolecularWeight: 469.81176

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1SC2=CC=C(C=C2)Cl)OC(=O)C3=C(C=C(C=C3)Cl)Cl)C(C)(C)C

Isomeric SMILES

CC1=NN(C(=C1SC2=CC=C(C=C2)Cl)OC(=O)C3=C(C=C(C=C3)Cl)Cl)C(C)(C)C

InChI

InChI=1S/C21H19Cl3N2O2S/c1-12-18(29-15-8-5-13(22)6-9-15)19(26(25-12)21(2,3)4)28-20(27)16-10-7-14(23)11-17(16)24/h5-11H,1-4H3