ethyl 5-[(3-chloranyl-4-fluoranyl-phenyl)sulfonylamino]-1H-pyrazole-4-carboxylate

Systemtic Name: ethyl 5-[(3-chloranyl-4-fluoranyl-phenyl)sulfonylamino]-1H-pyrazole-4-carboxylate Openeye Name: ethyl 5-[(3-chloro-4-fluoro-phenyl)sulfonylamino]-1H-pyrazole-4-carboxylate CAS Name: 5-[(3-chloro-4-fluorophenyl)sulfonylamino]-1H-pyrazole-4-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[(3-chloro-4-fluorophenyl)sulfonylamino]-1H-pyrazole-4-carboxylate Traditional Name: 5-[(3-chloro-4-fluoro-phenyl)sulfonylamino]-1H-pyrazole-4-carboxylic acid ethyl ester Formula: C12H11ClFN3O4S MolecularWeight: 347.749843

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NN=C1)NS(=O)(=O)C2=CC(=C(C=C2)F)Cl

Isomeric SMILES

CCOC(=O)C1=C(NN=C1)NS(=O)(=O)C2=CC(=C(C=C2)F)Cl

InChI

InChI=1S/C12H11ClFN3O4S/c1-2-21-12(18)8-6-15-16-11(8)17-22(19,20)7-3-4-10(14)9(13)5-7/h3-6H,2H2,1H3,(H2,15,16,17)