ethyl 4-[2-[3-(4-fluorophenyl)-6-oxidanylidene-pyridazin-1-yl]ethylsulfamoyl]benzoate

Systemtic Name: ethyl 4-[2-[3-(4-fluorophenyl)-6-oxidanylidene-pyridazin-1-yl]ethylsulfamoyl]benzoate Openeye Name: ethyl 4-[2-[3-(4-fluorophenyl)-6-oxo-pyridazin-1-yl]ethylsulfamoyl]benzoate CAS Name: 4-[2-[3-(4-fluorophenyl)-6-oxo-1-pyridazinyl]ethylsulfamoyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[2-[3-(4-fluorophenyl)-6-oxopyridazin-1-yl]ethylsulfamoyl]benzoate Traditional Name: 4-[2-[3-(4-fluorophenyl)-6-keto-pyridazin-1-yl]ethylsulfamoyl]benzoic acid ethyl ester Formula: C21H20FN3O5S MolecularWeight: 445.464003

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)NCCN2C(=O)C=CC(=N2)C3=CC=C(C=C3)F

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)NCCN2C(=O)C=CC(=N2)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H20FN3O5S/c1-2-30-21(27)16-5-9-18(10-6-16)31(28,29)23-13-14-25-20(26)12-11-19(24-25)15-3-7-17(22)8-4-15/h3-12,23H,2,13-14H2,1H3