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Substance Name: 2-(3-(6-Methoxy-5-methyl-3-(3-sulphonatopropyl)-3H-benzoselenazol-2-ylidene)-2-(methylthio)-1-propenyl)-1-methylnaphtho(1,2-d)thiazolium
RN: 94166-40-2
InChIKey: YIXGGWUUBQQLFX-UHFFFAOYSA-N

Molecular Formula

  • C28-H28-N2-O4-S3-Se

Molecular Weight

  • 631.6972
 
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Names and Synonyms

Synonym

  • EINECS 303-336-9

Systematic Name

  • 2-(3-(6-Methoxy-5-methyl-3-(3-sulphonatopropyl)-3H-benzoselenazol-2-ylidene)-2-(methylthio)-1-propenyl)-1-methylnaphtho(1,2-d)thiazolium

Registry Numbers

CAS Registry Number

  • 94166-40-2

System Generated Number

  • 0094166402

Structure Descriptors

InChI

1S/C28H28N2O4S3Se/c1-18-14-22-25(17-23(18)34-3)38-27(30(22)12-7-13-37(31,32)33)16-20(35-4)15-26-29(2)28-21-9-6-5-8-19(21)10-11-24(28)36-26/h5-6,8-11,14-17H,7,12-13H2,1-4H3

InChIKey

YIXGGWUUBQQLFX-UHFFFAOYSA-N

Smiles

[n+]1(c(sc2c1c1c(cc2)cccc1)/C=C(/C=c1/n(c2c([se]1)cc(c(c2)C)OC)CCCS(=O)(=O)[O-])SC)C