Compound Identification
SMILES
O=C(NC1=CC2=C(C=C1)N=C(SCCC1=CSC=C1)S2)C1=CN=CC(=N1)N1CCOCC1
InChIKey
InChIKey=QMDUKCICVNQVBA-UHFFFAOYSA-N
Formula
C22H21N5O2S3
Mass
483.62
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
Pyrazinecarboxamides 2-heteroaryl carboxamides Dialkylarylamines Alkylarylthioethers Aminopyrazines Benzenoids Imidolactams Morpholines Thiazoles Heteroaromatic compounds Thiophenes Secondary carboxylic acid amides Dialkyl ethers Azacyclic compounds Sulfenyl compounds Oxacyclic compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyrazinecarboxamide - Pyrazine carboxylic acid or derivatives - 1,3-benzothiazole - Dialkylarylamine - Aryl thioether - 2-heteroaryl carboxamide - Alkylarylthioether - Aminopyrazine - Morpholine - Oxazinane - Pyrazine - Imidolactam - Benzenoid - Azole - Thiophene - Heteroaromatic compound - Thiazole - Carboxamide group - Secondary carboxylic acid amide - Sulfenyl compound - Azacycle - Oxacycle - Ether - Dialkyl ether - Carboxylic acid derivative - Thioether - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Amine - 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