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Substance Name: TOTO 1
RN: 143413-84-7
InChIKey: MZZINWWGSYUHGU-UHFFFAOYSA-J

Note

  • Cpd is non-fluorescent in solution but forms highly fluorescent complex with double-stranded DNA.

Classification Codes

  • Coloring Agents
  • Fluorescent Dyes
  • Indicators and Reagents
  • Intercalating Agents
  • Luminescent Agents

Molecular Formula

  • C49-H58-N6-S2.4I

Molecular Weight

  • 1302.7712
 
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Names and Synonyms

Results Name

  • TOTO 1

Name of Substance

  • 1,1'-(4,4,7,7-Tetramethyl-4,7-diazaundecamethylene)bis-4-(3-methyl-2,3-dihydro(benzo-1,3-thiazole)-2-methylidene)quinolinium

Synonyms

  • 1,1'-(4,4,7,7-Tetramethyl-4,7-diazaundecamethylene)-bis-4-(3-methyl-2,3-dihydro-(benzo-1,3-thiazole)-2-methylidene)-quinolinium tetraiodide
  • 1,1'-(4,4,8,8-Tetramethyl-4,8-diazaundecamethylene)bis(4-(3-methyl-2,3-dihydrobenzo-1,3-thiazolyl)-2-methylidene)quinolinium tetraiodide
  • Toto-1

Systematic Names

  • 1,3-Propanediaminium, N,N,N',N'-tetramethyl-N,N'-bis(3-(4-((3-methyl-2(3H)-benzothiazolylidene)methyl)quinolinium-1-yl)propyl)-, tetraiodide
  • Quinolinium, 1,1'-(1,3-propanediylbis((dimethyliminio)-3,1-propanediyl))bis(4-((3-methyl-2(3H)-benzothiazolylidene)methyl)-, tetraiodide

Registry Numbers

CAS Registry Number

  • 143413-84-7

Other Registry Numbers

  • 146087-17-4
  • 169454-14-2
  • 174623-88-2

System Generated Number

  • 0143413847

Molecular Formulas

Molecular Formula

  • C49-H58-N6-S2.4I

Molecular Formula Fragments

  • C49-H58-N6-S2
  • COMPONENT
  • I

Structure Descriptors

InChI

1S/C49H58N6S2.4HI/c1-50-44-22-11-13-24-46(44)56-48(50)36-38-26-30-52(42-20-9-7-18-40(38)42)28-15-32-54(3,4)34-17-35-55(5,6)33-16-29-53-31-27-39(41-19-8-10-21-43(41)53)37-49-51(2)45-23-12-14-25-47(45)57-49;;;;/h7-14,18-27,30-31,36-37H,15-17,28-29,32-35H2,1-6H3;4*1H/q+4;;;;/p-4

InChIKey

MZZINWWGSYUHGU-UHFFFAOYSA-J

Smiles

C(CC[N+](CCC[n+]1ccc(c2ccccc12)\C=C1/Sc2c(N1C)cccc2)(C)C)[N+](CCC[n+]1ccc(c2ccccc12)\C=C1/Sc2c(N1C)cccc2)(C)C.[IH-].[IH-].[IH-].[IH-]