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Substance Name: 5-((4-(6-Methylbenzothiazol-2-yl)phenyl)azo)barbituric acid, mono((1-methyl-1H-imidazolyl)methyl) derivative, monoacetate
RN: 84985-82-0
InChIKey: DAGIZVDLOSJSAK-RXQWRGDBSA-N

Molecular Formula

  • C23-H19-N7-O3-S.C2-H4-O2

Molecular Weight

  • 533.5667
 
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Names and Synonyms

Synonym

  • EINECS 284-847-3

Systematic Name

  • 5-((4-(6-Methylbenzothiazol-2-yl)phenyl)azo)barbituric acid, mono((1-methyl-1H-imidazolyl)methyl) derivative, monoacetate

Registry Numbers

CAS Registry Number

  • 84985-82-0

System Generated Number

  • 0084985820

Molecular Formulas

Molecular Formula

  • C23-H19-N7-O3-S.C2-H4-O2

Molecular Formula Fragments

  • C2-H4-O2
  • C23-H19-N7-O3-S
  • COMPONENT

Structure Descriptors

InChI

1S/C23H19N7O3S.C2H4O2/c1-13-3-8-16-17(11-13)34-21(25-16)14-4-6-15(7-5-14)27-28-19-20(31)26-23(33)30(22(19)32)12-18-24-9-10-29(18)2;1-2(3)4/h3-11,19H,12H2,1-2H3,(H,26,31,33);1H3,(H,3,4)/b28-27+;

InChIKey

DAGIZVDLOSJSAK-RXQWRGDBSA-N

Smiles

N1(C(=O)NC(=O)C(C1=O)/N=N/c1ccc(c2nc3c(s2)cc(cc3)C)cc1)Cc1n(ccn1)C.C(=O)(O)C