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Substance Name: Benzothiazolium, 3-(3-amino-3-oxopropyl)-2-(2-(4-(diethylamino)phenyl)diazenyl)-6-ethoxy-, chloride (1:1)
RN: 12221-38-4
InChIKey: POELEEGOWIJNBI-UHFFFAOYSA-N

Molecular Formula

  • C22-H28-N5-O2-S.Cl

Molecular Weight

  • 462.015
 
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Names and Synonyms

Synonym

  • EINECS 235-411-6

Systematic Names

  • 3-(3-Amino-3-oxopropyl)-2-((4-(diethylamino)phenyl)azo)-6-ethoxybenzothiazolium chloride
  • Benzothiazolium, 3-(3-amino-3-oxopropyl)-2-((4-(diethylamino)phenyl)azo)-6-ethoxy-, chloride
  • Benzothiazolium, 3-(3-amino-3-oxopropyl)-2-(2-(4-(diethylamino)phenyl)diazenyl)-6-ethoxy-, chloride (1:1)

Registry Numbers

CAS Registry Number

  • 12221-38-4

System Generated Number

  • 0012221384

Molecular Formulas

Molecular Formula

  • C22-H28-N5-O2-S.Cl

Molecular Formula Fragments

  • C22-H28-N5-O2-S
  • Cl
  • COMPONENT

Structure Descriptors

InChI

1S/C22H27N5O2S.ClH/c1-4-26(5-2)17-9-7-16(8-10-17)24-25-22-27(14-13-21(23)28)19-12-11-18(29-6-3)15-20(19)30-22;/h7-12,15H,4-6,13-14H2,1-3H3,(H-,23,28);1H

InChIKey

POELEEGOWIJNBI-UHFFFAOYSA-N

Smiles

[n+]1(c(sc2c1ccc(OCC)c2)\N=N\c1ccc(cc1)N(CC)CC)CCC(=O)N.[ClH-]