ethyl 5-(4-chlorophenyl)-1-(2,4-dichlorophenyl)-4-methylsulfanyl-pyrazole-3-carboxylate

Systemtic Name: ethyl 5-(4-chlorophenyl)-1-(2,4-dichlorophenyl)-4-methylsulfanyl-pyrazole-3-carboxylate Openeye Name: ethyl 5-(4-chlorophenyl)-1-(2,4-dichlorophenyl)-4-methylsulfanyl-pyrazole-3-carboxylate CAS Name: 5-(4-chlorophenyl)-1-(2,4-dichlorophenyl)-4-(methylthio)-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(4-chlorophenyl)-1-(2,4-dichlorophenyl)-4-methylsulfanylpyrazole-3-carboxylate Traditional Name: 5-(4-chlorophenyl)-1-(2,4-dichlorophenyl)-4-(methylthio)pyrazole-3-carboxylic acid ethyl ester Formula: C19H15Cl3N2O2S MolecularWeight: 441.7586

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=C1SC)C2=CC=C(C=C2)Cl)C3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CCOC(=O)C1=NN(C(=C1SC)C2=CC=C(C=C2)Cl)C3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C19H15Cl3N2O2S/c1-3-26-19(25)16-18(27-2)17(11-4-6-12(20)7-5-11)24(23-16)15-9-8-13(21)10-14(15)22/h4-10H,3H2,1-2H3