sodium 4-[4-[[3-[(2-ethylphenyl)sulfamoyl]-4-methyl-phenyl]diazenyl]-3-methyl-5-oxidanylidene-4H-pyrazol-1-yl]benzenesulfonate

Systemtic Name: sodium 4-[4-[[3-[(2-ethylphenyl)sulfamoyl]-4-methyl-phenyl]diazenyl]-3-methyl-5-oxidanylidene-4H-pyrazol-1-yl]benzenesulfonate Openeye Name: sodium 4-[4-[3-[(2-ethylphenyl)sulfamoyl]-4-methyl-phenyl]azo-3-methyl-5-oxo-4H-pyrazol-1-yl]benzenesulfonate CAS Name: sodium 4-[4-[3-[(2-ethylphenyl)sulfamoyl]-4-methylphenyl]azo-3-methyl-5-oxo-4H-pyrazol-1-yl]benzenesulfonate IUPAC Name: sodium 4-[4-[[3-[(2-ethylphenyl)sulfamoyl]-4-methylphenyl]diazenyl]-3-methyl-5-oxo-4H-pyrazol-1-yl]benzenesulfonate Traditional Name: sodium 4-[4-[3-[(2-ethylphenyl)sulfamoyl]-4-methyl-phenyl]azo-5-keto-3-methyl-2-pyrazolin-1-yl]besylate Formula: C25H24N5NaO6S2 MolecularWeight: 577.60773

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NS(=O)(=O)C2=C(C=CC(=C2)N=NC3C(=NN(C3=O)C4=CC=C(C=C4)S(=O)(=O)[O-])C)C.[Na+]

Isomeric SMILES

CCC1=CC=CC=C1NS(=O)(=O)C2=C(C=CC(=C2)N=NC3C(=NN(C3=O)C4=CC=C(C=C4)S(=O)(=O)[O-])C)C.[Na+]

InChI

InChI=1S/C25H25N5O6S2.Na/c1-4-18-7-5-6-8-22(18)29-37(32,33)23-15-19(10-9-16(23)2)26-27-24-17(3)28-30(25(24)31)20-11-13-21(14-12-20)38(34,35)36;/h5-15,24,29H,4H2,1-3H3,(H,34,35,36);/q;+1/p-1