Compound Identification
SMILES
OC(=O)CCCCC[N+]1=C(SC2=CC=CC=C12)\C=C1/CCC2CCC(\C=C3/SC4=CC=CC=C4N3CCCCC(=C)O[O-])=CC2=C1
InChIKey
InChIKey=WYTRSJVPLYHOGL-UHFFFAOYSA-N
Formula
C38H42N2O4S2
Mass
654.88
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 Medium-chain fatty acids Heterocyclic fatty acids Benzenoids Thiazoles Heteroaromatic compounds Tertiary amines Amino acids Ketene acetals Organic peroxides Monocarboxylic acids and derivatives Azacyclic compounds Carboxylic acids Carbonyl compounds Hydrocarbon derivatives Organic salts Organic zwitterions
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzo-thiazole - 1,2-benzothiazole - 1,3-benzothiazole - Aryl thioether - Medium-chain fatty acid - Heterocyclic fatty acid - Fatty acyl - Benzenoid - Azole - Thiazole - Heteroaromatic compound - Ketene acetal or derivatives - Amino acid or derivatives - Tertiary amine - Amino acid - Carboxylic acid - Organic peroxide - Monocarboxylic acid or derivatives - Azacycle - Carboxylic acid derivative - Amine - Organonitrogen compound - Organooxygen compound - Organic zwitterion - Carbonyl group - Organic salt - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - 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
Not available