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Substance Name: 2,5-Dichloro-4-(4-((5-((4,6-dichloro-1,3,5-triazin-2-yl)amino)-2-sulphophenyl)azo)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl)benzenesulphonic acid
RN: 25489-31-0
InChIKey: WCTIHMSDUHSUHQ-ZQHSETAFSA-N

Molecular Formula

  • C19-H12-Cl4-N8-O7-S2

Molecular Weight

  • 670.297
 
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Names and Synonyms

Synonym

  • EINECS 247-025-5

Systematic Name

  • 2,5-Dichloro-4-(4-((5-((4,6-dichloro-1,3,5-triazin-2-yl)amino)-2-sulphophenyl)azo)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl)benzenesulphonic acid

Registry Numbers

CAS Registry Number

  • 25489-31-0

System Generated Number

  • 0025489310

Structure Descriptors

InChI

1S/C19H12Cl4N8O7S2/c1-7-15(16(32)31(30-7)12-5-10(21)13(6-9(12)20)39(33,34)35)29-28-11-3-2-8(4-14(11)40(36,37)38)24-19-26-17(22)25-18(23)27-19/h2-6,15H,1H3,(H,33,34,35)(H,36,37,38)(H,24,25,26,27)/b29-28+

InChIKey

WCTIHMSDUHSUHQ-ZQHSETAFSA-N

Smiles

N1(C([C@@H](\N=N\c2c(S(=O)(=O)O)cc(Nc3nc(Cl)nc(n3)Cl)cc2)C(=N1)C)=O)c1cc(Cl)c(S(=O)(=O)O)cc1Cl