Compound Identification
SMILES
CN1\C(SC2=CC=CC=C12)=C\C1=CC=[N+](CCC[N+](C)(C)CCC[N+](C)(C)CCC[N+]2=CC=C(\C=C3/SC4=CC=CC=C4N3C)C=C2)C=C1
InChIKey
InChIKey=OUIWRUVXYIBBQY-UHFFFAOYSA-N
Formula
C41H54N6S2
Mass
695.04
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzothiazoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzothiazoles
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzothiazoles
Alternative Parents
Aryl thioethers Pyridinium derivatives Benzenoids Thiazoles Tetraalkylammonium salts Heteroaromatic compounds Ketene acetals Azacyclic compounds Organopnictogen compounds Organic salts Hydrocarbon derivatives Amines Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzo-thiazole - 1,2-benzothiazole - 1,3-benzothiazole - Aryl thioether - Pyridine - Pyridinium - Benzenoid - Tetraalkylammonium salt - Heteroaromatic compound - Quaternary ammonium salt - Thiazole - Ketene acetal or derivatives - Azacycle - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Amine - Organopnictogen compound - Organic salt - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzothiazoles. These are organic compounds containing a benzene fused to a thiazole ring (a five-membered ring with four carbon atoms, one nitrogen atom and one sulfur atom).
External Descriptors
CHEBI:52802 : cyanine dye - organic cation