Compound Identification
SMILES
COC(=O)C1=CC2=C(C=C1)N=C(NC(=S)N1CCSCC1)S2
InChIKey
InChIKey=LKBMKKNDGLLHMX-UHFFFAOYSA-N
Formula
C14H15N3O2S3
Mass
353.47
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
Thiomorpholines Benzenoids Thiazoles Methyl esters Heteroaromatic compounds Thioureas Dialkylthioethers Azacyclic compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,3-benzothiazole - 1,4-thiazinane - Benzenoid - Azole - Thiazole - Heteroaromatic compound - Methyl ester - Carboxylic acid ester - Thiourea - Carboxylic acid derivative - Thioether - Azacycle - Dialkylthioether - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic oxide - Hydrocarbon derivative - Organic nitrogen 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