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4-[5-[(E)-[3-methyl-5-oxo-1-(4-sulfamoylphenyl)-4-pyrazolylidene]methyl]-2-furanyl]benzoic acid methyl ester
SpectraBase Compound ID G074CrI8CRt
InChI InChI=1S/C23H19N3O6S/c1-14-20(22(27)26(25-14)17-7-10-19(11-8-17)33(24,29)30)13-18-9-12-21(32-18)15-3-5-16(6-4-15)23(28)31-2/h3-13H,1-2H3,(H2,24,29,30)/b20-13+
InChIKey DGZURHPMPKEPHX-DEDYPNTBSA-N
Mol Weight 465.48 g/mol
Molecular Formula C23H19N3O6S
Exact Mass 465.099457 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8dLthYvAFZT
Name 4-[5-[(E)-[3-methyl-5-oxo-1-(4-sulfamoylphenyl)-4-pyrazolylidene]methyl]-2-furanyl]benzoic acid methyl ester
Alternate Name(s) 4-[5-[(E)-[5-keto-3-methyl-1-(4-sulfamoylphenyl)-2-pyrazolin-4-ylidene]methyl]-2-furyl]benzoic acid methyl ester Methyl 4-[5-({1-[4-(aminosulfonyl)phenyl]-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene}methyl)-2-furyl]benzoate Methyl 4-[5-[(E)-[3-methyl-5-oxidanylidene-1-(4-sulfamoylphenyl)pyrazol-4-ylidene]methyl]furan-2-yl]benzoate Methyl 4-[5-[(E)-[3-methyl-5-oxo-1-(4-sulfamoylphenyl)pyrazol-4-ylidene]methyl]-2-furyl]benzoate Methyl 4-[5-[(E)-[3-methyl-5-oxo-1-(4-sulfamoylphenyl)pyrazol-4-ylidene]methyl]furan-2-yl]benzoate
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Formula C23H19N3O6S
InChI InChI=1S/C23H19N3O6S/c1-14-20(22(27)26(25-14)17-7-10-19(11-8-17)33(24,29)30)13-18-9-12-21(32-18)15-3-5-16(6-4-15)23(28)31-2/h3-13H,1-2H3,(H2,24,29,30)/b20-13+
InChIKey DGZURHPMPKEPHX-DEDYPNTBSA-N
Molecular Weight 465.480 g/mol
SMILES NS(c1ccc(N2C(\C(C(=N2)C)=C\c2oc(-c3ccc(C(=O)OC)cc3)cc2)=O)cc1)(=O)=O
SPLASH splash10-0hfx-8920000000-c9664f0f8963e7d1b79d
Wiley ID 1436996