ethyl 2-[4-(3-fluoranyl-4-methyl-phenyl)-3-(4-sulfamoylphenyl)pyrazol-1-yl]ethanoate

Systemtic Name: ethyl 2-[4-(3-fluoranyl-4-methyl-phenyl)-3-(4-sulfamoylphenyl)pyrazol-1-yl]ethanoate Openeye Name: ethyl 2-[4-(3-fluoro-4-methyl-phenyl)-3-(4-sulfamoylphenyl)pyrazol-1-yl]acetate CAS Name: 2-[4-(3-fluoro-4-methylphenyl)-3-(4-sulfamoylphenyl)-1-pyrazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-(3-fluoro-4-methylphenyl)-3-(4-sulfamoylphenyl)pyrazol-1-yl]acetate Traditional Name: 2-[4-(3-fluoro-4-methyl-phenyl)-3-(4-sulfamoylphenyl)pyrazol-1-yl]acetic acid ethyl ester Formula: C20H20FN3O4S MolecularWeight: 417.453903

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C=C(C(=N1)C2=CC=C(C=C2)S(=O)(=O)N)C3=CC(=C(C=C3)C)F

Isomeric SMILES

CCOC(=O)CN1C=C(C(=N1)C2=CC=C(C=C2)S(=O)(=O)N)C3=CC(=C(C=C3)C)F

InChI

InChI=1S/C20H20FN3O4S/c1-3-28-19(25)12-24-11-17(15-5-4-13(2)18(21)10-15)20(23-24)14-6-8-16(9-7-14)29(22,26)27/h4-11H,3,12H2,1-2H3,(H2,22,26,27)