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Substance Name: 2-(3-(3-Ethyl-3H-benzothiazol-2-ylidene)isobut-1-enyl)-3-(4-sulphonatobutyl)benzothiazolium
RN: 30457-66-0
InChIKey: ZCJPIQRUDMDSMK-UHFFFAOYSA-N

Molecular Formula

  • C24-H26-N2-O3-S3

Molecular Weight

  • 486.678
 
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Names and Synonyms

Synonym

  • EINECS 250-208-2

Systematic Name

  • 2-(3-(3-Ethyl-3H-benzothiazol-2-ylidene)isobut-1-enyl)-3-(4-sulphonatobutyl)benzothiazolium

Registry Numbers

CAS Registry Number

  • 30457-66-0

System Generated Number

  • 0030457660

Structure Descriptors

InChI

1S/C24H26N2O3S3/c1-3-25-19-10-4-6-12-21(19)30-23(25)16-18(2)17-24-26(14-8-9-15-32(27,28)29)20-11-5-7-13-22(20)31-24/h4-7,10-13,16-17H,3,8-9,14-15H2,1-2H3

InChIKey

ZCJPIQRUDMDSMK-UHFFFAOYSA-N

Smiles

C1(\N(c2ccccc2S1)CC)=C\C(=C\c1[n+](c2ccccc2s1)CCCCS(=O)(=O)[O-])C