ethyl 4-[3,5-bis(chloranyl)phenyl]sulfanyl-5-ethyl-1H-pyrazole-3-carboxylate

Systemtic Name: ethyl 4-[3,5-bis(chloranyl)phenyl]sulfanyl-5-ethyl-1H-pyrazole-3-carboxylate Openeye Name: ethyl 4-(3,5-dichlorophenyl)sulfanyl-5-ethyl-1H-pyrazole-3-carboxylate CAS Name: 4-[(3,5-dichlorophenyl)thio]-5-ethyl-1H-pyrazole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(3,5-dichlorophenyl)sulfanyl-5-ethyl-1H-pyrazole-3-carboxylate Traditional Name: 4-[(3,5-dichlorophenyl)thio]-5-ethyl-1H-pyrazole-3-carboxylic acid ethyl ester Formula: C14H14Cl2N2O2S MolecularWeight: 345.24416

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NN1)C(=O)OCC)SC2=CC(=CC(=C2)Cl)Cl

Isomeric SMILES

CCC1=C(C(=NN1)C(=O)OCC)SC2=CC(=CC(=C2)Cl)Cl

InChI

InChI=1S/C14H14Cl2N2O2S/c1-3-11-13(12(18-17-11)14(19)20-4-2)21-10-6-8(15)5-9(16)7-10/h5-7H,3-4H2,1-2H3,(H,17,18)