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Substance Name: Benzothiazolium, 2-(((4-(dimethylamino)phenyl)imino)methyl)-3-ethyl-, ethyl sulfate (1:1)
RN: 29770-19-2
InChIKey: XJITZQQGJPTYCJ-UHFFFAOYSA-M

Molecular Formula

  • C18-H20-N3-S.C2-H5-O4-S

Molecular Weight

  • 435.566
 
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Names and Synonyms

Synonym

  • EINECS 249-835-4

Systematic Names

  • 2-(N-(p-(Dimethylamino)phenyl)formimidoyl)-3-ethylbenzothiazolium ethyl sulphate
  • Benzothiazolium, 2-(((4-(dimethylamino)phenyl)imino)methyl)-3-ethyl-, ethyl sulfate
  • Benzothiazolium, 2-(((4-(dimethylamino)phenyl)imino)methyl)-3-ethyl-, ethyl sulfate (1:1)

Registry Numbers

CAS Registry Number

  • 29770-19-2

System Generated Number

  • 0029770192

Molecular Formulas

Molecular Formula

  • C18-H20-N3-S.C2-H5-O4-S

Molecular Formula Fragments

  • C18-H20-N3-S
  • C2-H5-O4-S
  • COMPONENT

Structure Descriptors

InChI

1S/C18H20N3S.C2H6O4S/c1-4-21-16-7-5-6-8-17(16)22-18(21)13-19-14-9-11-15(12-10-14)20(2)3;1-2-6-7(3,4)5/h5-13H,4H2,1-3H3;2H2,1H3,(H,3,4,5)/q+1;/p-1

InChIKey

XJITZQQGJPTYCJ-UHFFFAOYSA-M

Smiles

s1c(\C=N\c2ccc(cc2)N(C)C)[n+](CC)c2c1cccc2.S(=O)(=O)(OCC)[O-]