Compound Identification
SMILES
CCN1C(SCC2=NC3=CC=CC=C3S2)=NC2=C1C=CC(=C2)S(=O)(=O)N1CCOCC1
InChIKey
InChIKey=YJPPFXWHLBICHZ-UHFFFAOYSA-N
Formula
C21H22N4O3S3
Mass
474.61
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
Benzimidazoles Alkylarylthioethers Benzenoids Morpholines N-substituted imidazoles Organosulfonamides Thiazoles Heteroaromatic compounds Sulfonyls Azacyclic compounds Dialkyl ethers Oxacyclic compounds Sulfenyl compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzimidazole - 1,3-benzothiazole - Aryl thioether - Alkylarylthioether - Morpholine - N-substituted imidazole - Oxazinane - Organosulfonic acid amide - Benzenoid - Heteroaromatic compound - Imidazole - Azole - Organic sulfonic acid or derivatives - Thiazole - Sulfonyl - Organosulfonic acid or derivatives - Oxacycle - Azacycle - Ether - Dialkyl ether - Sulfenyl compound - Thioether - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - Organopnictogen compound - Organic oxygen 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