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CHEBI:52293 - thiazole orange

ChEBI IDCHEBI:52293
ChEBI Namethiazole orange
Stars
DefinitionA cyanine dye comprising the thiazole orange cation [1-methyl-4-[(3-methyl-1,3-benzothiazol-2(3H)-ylidene)methyl]quinolinium] with the p-tosylate counterion.
Last Modified20 May 2016
SubmitterInma Spiteri
DownloadsMolfile
FormulaC19H17N2S.C7H7O3S
Net Charge0
Average Mass476.623
Monoisotopic Mass476.12283
SMILESCc1ccc(S(=O)(=O)[O-])cc1.[H]C(=C1Sc2ccccc2N1C)c1cc[n+](C)c2ccccc12
InChIInChI=1S/C19H17N2S.C7H8O3S/c1-20-12-11-14(15-7-3-4-8-16(15)20)13-19-21(2)17-9-5-6-10-18(17)22-19;1-6-2-4-7(5-3-6)11(8,9)10/h3-13H,1-2H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1
InChIKeyACOJCCLIDPZYJC-UHFFFAOYSA-M
Roles Classification
Applications:
fluorochrome  A fluorescent dye used to stain biological specimens.
dye 
ChEBI Ontology
Outgoing Relation(s)
thiazole orange (CHEBI:52293) has part thiazole orange cation (CHEBI:52924)
thiazole orange (CHEBI:52293) has role fluorochrome (CHEBI:51217)
thiazole orange (CHEBI:52293) is a cyanine dye (CHEBI:37960)
IUPAC Names 
1-methyl-4-[(3-methyl-1,3-benzothiazol-2(3H)-ylidene)methyl]quinolinium 4-methylbenzenesulfonate
3-methyl-2-[(1-methylquinolin-4(1H)-ylidene)methyl]-1,3-benzothiazol-3-ium 4-methylbenzenesulfonate
Synonyms  Source
1-methyl-4-[(3-methyl-2(3H)-benzothiazolylidene)methyl]quinolinium p-tosylateChEBI
1-methyl-4-((3-methyl-2(3H)-benzothiazolylidene)methyl)quinolinium, salt with 4-methylbenzenesulfonic acid (1:1)ChemIDplus
TO1-2pChEBI
Registry NumbersSources
Beilstein:11376685Beilstein
Reaxys:15037459Reaxys
CAS:107091-89-4ChemIDplus
Citations