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Substance Name: Benzothiazolium, 3-ethyl-2-(2-((3-ethyl-5-methoxy-2(3H)-benzoselenazolylidene)methyl)-1-buten-1-yl)-6-methyl-, iodide (1:1)
RN: 63816-16-0
InChIKey: CQAPUGWAMRGZBV-UHFFFAOYSA-M

Molecular Formula

  • C25-H29-N2-O-S-Se.I

Molecular Weight

  • 611.443
 
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Names and Synonyms

Synonyms

  • Benzothiazolium. 3-ethyl-2-(2-((3-ethyl-5-methoxy-2(3H)-benzoselenazolylidene)methyl)-1-butenyl)-6-methyl-, iodide
  • EINECS 264-494-1

Systematic Names

  • 3-Ethyl-2-(2-((3-ethyl-5-methoxy-3H-benzoselenazol-2-ylidene)methyl)but-1-enyl)-6-methylbenzothiazolium iodide
  • Benzothiazolium, 3-ethyl-2-(2-((3-ethyl-5-methoxy-2(3H)-benzoselenazolylidene)methyl)-1-buten-1-yl)-6-methyl-, iodide (1:1)
  • Benzothiazolium, 3-ethyl-2-(2-((3-ethyl-5-methoxy-2(3H)-benzoselenazolylidene)methyl)-1-butenyl)-6-methyl-, iodide

Registry Numbers

CAS Registry Number

  • 63816-16-0

System Generated Number

  • 0063816160

Molecular Formulas

Molecular Formula

  • C25-H29-N2-O-S-Se.I

Molecular Formula Fragments

  • C25-H29-N2-O-S-Se
  • COMPONENT
  • I

Structure Descriptors

InChI

1S/C25H29N2OSSe.HI/c1-6-18(14-24-26(7-2)20-11-9-17(4)13-22(20)29-24)15-25-27(8-3)21-16-19(28-5)10-12-23(21)30-25;/h9-16H,6-8H2,1-5H3;1H/q+1;/p-1

InChIKey

CQAPUGWAMRGZBV-UHFFFAOYSA-M

Smiles

C1(=C/C(=C\c2[n+](c3c(cc(cc3)C)s2)CC)CC)\N(c2cc(OC)ccc2[Se]1)CC.[IH-]