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Substance Name: Benzothiazolium, 5-chloro-2-((5-((5-chloro-1,3-diethyl-1,3-dihydro-2H-benzimidazol-2-ylidene)ethylidene)-3-ethyl-4-oxo-2-thiazolidinylidene)methyl)-3-ethyl-, iodide
RN: 106068-87-5
InChIKey: NECZYORCIMJPSG-LUCHRDHLSA-M

Molecular Formula

  • C28-H29-Cl2-N4-O-S2.I

Molecular Weight

  • 699.5021
 
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Names and Synonyms

  • Benzothiazolium, 5-chloro-2-((5-((5-chloro-1,3-diethyl-1,3-dihydro-2H-benzimidazol-2-ylidene)ethylidene)-3-ethyl-4-oxo-2-thiazolidinylidene)methyl)-3-ethyl-, iodide

Registry Numbers

CAS Registry Number

  • 106068-87-5

System Generated Number

  • 0106068875

Molecular Formulas

Molecular Formula

  • C28-H29-Cl2-N4-O-S2.I

Molecular Formula Fragments

  • C28-H29-Cl2-N4-O-S2
  • COMPONENT
  • I

Structure Descriptors

InChI

1S/C28H29Cl2N4OS2.HI/c1-5-31-20-11-9-18(29)15-21(20)32(6-2)25(31)14-13-24-28(35)34(8-4)27(37-24)17-26-33(7-3)22-16-19(30)10-12-23(22)36-26;/h9-17H,5-8H2,1-4H3;1H/q+1;/p-1/b24-13-,25-14+;

InChIKey

NECZYORCIMJPSG-LUCHRDHLSA-M

Smiles

CCn1/c(=C/c2[n+](c3cc(ccc3s2)Cl)CC)/s/c(=C\C=C\4/N(c5ccc(cc5N4CC)Cl)CC)/c1=O.[I-]