ethyl 5-thiophen-2-yl-2-[2,4,6-tris(chloranyl)phenyl]pyrazole-3-carboxylate

Systemtic Name: ethyl 5-thiophen-2-yl-2-[2,4,6-tris(chloranyl)phenyl]pyrazole-3-carboxylate Openeye Name: ethyl 5-(2-thienyl)-2-(2,4,6-trichlorophenyl)pyrazole-3-carboxylate CAS Name: 5-thiophen-2-yl-2-(2,4,6-trichlorophenyl)-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-thiophen-2-yl-2-(2,4,6-trichlorophenyl)pyrazole-3-carboxylate Traditional Name: 5-(2-thienyl)-2-(2,4,6-trichlorophenyl)pyrazole-3-carboxylic acid ethyl ester Formula: C16H11Cl3N2O2S MolecularWeight: 401.69474

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=NN1C2=C(C=C(C=C2Cl)Cl)Cl)C3=CC=CS3

Isomeric SMILES

CCOC(=O)C1=CC(=NN1C2=C(C=C(C=C2Cl)Cl)Cl)C3=CC=CS3

InChI

InChI=1S/C16H11Cl3N2O2S/c1-2-23-16(22)13-8-12(14-4-3-5-24-14)20-21(13)15-10(18)6-9(17)7-11(15)19/h3-8H,2H2,1H3