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Substance Name: 4-(4-((3-((Ethylanilino)sulphonyl)-4-methylphenyl)azo)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl)benzenesulphonic acid
RN: 83006-48-8
InChIKey: BGPWYLNVCADBHC-CYYJNZCTSA-N

Molecular Formula

  • C25-H25-N5-O6-S2

Molecular Weight

  • 555.6335
 
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Names and Synonyms

Synonym

  • EINECS 280-098-1

Systematic Names

  • 4-(4-((3-((Ethylanilino)sulphonyl)-4-methylphenyl)azo)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl)benzenesulphonic acid
  • Benzenesulfonic acid, 4-(4-((3-((ethylphenylamino)sulfonyl)-4-methylphenyl)azo)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl)-

Registry Numbers

CAS Registry Number

  • 83006-48-8

System Generated Number

  • 0083006488

Structure Descriptors

InChI

1S/C25H25N5O6S2/c1-4-29(20-8-6-5-7-9-20)37(32,33)23-16-19(11-10-17(23)2)26-27-24-18(3)28-30(25(24)31)21-12-14-22(15-13-21)38(34,35)36/h5-16,24H,4H2,1-3H3,(H,34,35,36)/b27-26+

InChIKey

BGPWYLNVCADBHC-CYYJNZCTSA-N

Smiles

CCN(c1ccccc1)S(=O)(=O)c2cc(ccc2C)/N=N/C3C(=NN(C3=O)c4ccc(cc4)S(=O)(=O)O)C