Compound Identification
SMILES
CCOP(O)(=O)C(CC)CNC(=O)CS(=O)C1=CC=C(NC2=NC3=CC=CC=C3S2)C=C1
InChIKey
InChIKey=WHUOOXKSNLAFCS-UHFFFAOYSA-N
Formula
C21H26N3O5PS2
Mass
495.55
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
Phenyl sulfoxides Aniline and substituted anilines 2-amino-1,3-thiazoles Phosphonic acid esters Organic phosphonic acids Heteroaromatic compounds Sulfoxides Secondary carboxylic acid amides Amino acids and derivatives Sulfinyl compounds Secondary amines Azacyclic compounds Organophosphorus compounds Carbonyl compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,3-benzothiazole - Phenyl sulfoxide - Aniline or substituted anilines - Monocyclic benzene moiety - Phosphonic acid ester - Benzenoid - 1,3-thiazol-2-amine - Azole - Heteroaromatic compound - Thiazole - Organophosphonic acid - Organophosphonic acid derivative - Sulfoxide - Secondary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Azacycle - Sulfinyl compound - Secondary amine - Carboxylic acid derivative - Organic oxide - Organonitrogen compound - Organooxygen compound - Organophosphorus compound - Organosulfur compound - Carbonyl group - Organic nitrogen compound - Amine - Organic oxygen compound - Hydrocarbon derivative - 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