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CHEBI:52787 - dithiazanine
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ChEBI Name
dithiazanine
ChEBI ID
CHEBI:52787
Definition
A cationic C3-cyanine dye with 3-ethylbenzothiazol-2-yl groups at both ends.
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This entity has been manually annotated by the ChEBI Team.
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Formula
C23H23N2S2
Net Charge
+1
Average Mass
391.57200
Monoisotopic Mass
391.12972
InChI
InChI=1S/C23H23N2S2/c1-
3-
24-
18-
12-
8-
10-
14-
20(18)
26-
22(24)
16-
6-
5-
7-
17-
23-
25(4-
2)
19-
13-
9-
11-
15-
21(19)
27-
23/h5-
17H,3-
4H2,1-
2H3/q+1
InChIKey
FYXWDSGGZAMYFZ-UHFFFAOYSA-N
SMILES
[H]C(=C([H])C([H])=C1Sc2ccccc2N1CC)C([H])=C([H])c1sc2ccccc2[n+]1CC
Roles Classification
Application
(s):
fluorochrome
A fluorescent dye used to stain biological specimens.
anthelminthic drug
Substance intended to kill parasitic worms (helminths).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
dithiazanine (
CHEBI:52787
)
has role
anthelminthic drug (
CHEBI:35443
)
dithiazanine (
CHEBI:52787
)
has role
fluorochrome (
CHEBI:51217
)
dithiazanine (
CHEBI:52787
)
is a
benzothiazoles (
CHEBI:37947
)
dithiazanine (
CHEBI:52787
)
is a
benzothiazolium ion (
CHEBI:52838
)
Incoming
dithiazanine iodide (
CHEBI:228275
)
has part
dithiazanine (
CHEBI:52787
)
IUPAC Name
3-
ethyl-
2-
[5-
(3-
ethyl-
1,3-
benzothiazol-
2(3
H
)-
ylidene)penta-
1,3-
dien-
1-
yl]-
1,3-
benzothiazol-
3-
ium
Synonyms
Sources
3,3'-diethylthiadicarbocyanine
ChEBI
Dithiazanine
ChemIDplus
Dithiazaninum
ChemIDplus
Manual Xref
Database
930
DrugCentral
View more database links
Registry Number
Type
Source
7187-55-5
CAS Registry Number
ChemIDplus
Last Modified
22 February 2017