methyl 2-[(4Z)-5-oxidanylidene-1-phenyl-4-[1-[(4-sulfamoylphenyl)methylamino]ethylidene]pyrazol-3-yl]ethanoate

Systemtic Name: methyl 2-[(4Z)-5-oxidanylidene-1-phenyl-4-[1-[(4-sulfamoylphenyl)methylamino]ethylidene]pyrazol-3-yl]ethanoate Openeye Name: methyl 2-[(4Z)-5-oxo-1-phenyl-4-[1-[(4-sulfamoylphenyl)methylamino]ethylidene]pyrazol-3-yl]acetate CAS Name: 2-[(4Z)-5-oxo-1-phenyl-4-[1-[(4-sulfamoylphenyl)methylamino]ethylidene]-3-pyrazolyl]acetic acid methyl ester IUPAC Name: methyl 2-[(4Z)-5-oxo-1-phenyl-4-[1-[(4-sulfamoylphenyl)methylamino]ethylidene]pyrazol-3-yl]acetate Traditional Name: 2-[(4Z)-5-keto-1-phenyl-4-[1-[(4-sulfamoylbenzyl)amino]ethylidene]-2-pyrazolin-3-yl]acetic acid methyl ester Formula: C21H22N4O5S MolecularWeight: 442.48818

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C1C(=NN(C1=O)C2=CC=CC=C2)CC(=O)OC)NCC3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

C/C(=C/1\C(=NN(C1=O)C2=CC=CC=C2)CC(=O)OC)/NCC3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C21H22N4O5S/c1-14(23-13-15-8-10-17(11-9-15)31(22,28)29)20-18(12-19(26)30-2)24-25(21(20)27)16-6-4-3-5-7-16/h3-11,23H,12-13H2,1-2H3,(H2,22,28,29)/b20-14-