Compound Identification
SMILES
CCC1=C(C)NC(=N1)C(=O)N[C@@H]1CCN(C[C@@H]1OC)C1=NC2=CC=CC(C(O)=O)=C2S1
InChIKey
InChIKey=GLVLCQUPRXOQEU-ZBFHGGJFSA-N
Formula
C21H25N5O4S
Mass
443.52
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
Dialkylarylamines 2-heteroaryl carboxamides 2,4,5-trisubstituted imidazoles Piperidines Benzenoids 2-amino-1,3-thiazoles Heteroaromatic compounds Secondary carboxylic acid amides Amino acids Dialkyl ethers Carboxylic acids Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,3-benzothiazole - 2-heteroaryl carboxamide - 2,4,5-trisubstituted-imidazole - Trisubstituted imidazole - Dialkylarylamine - Piperidine - Benzenoid - 1,3-thiazol-2-amine - Imidazole - Thiazole - Azole - Heteroaromatic compound - Amino acid or derivatives - Secondary carboxylic acid amide - Amino acid - Tertiary amine - Carboxamide group - Azacycle - Carboxylic acid derivative - Carboxylic acid - Dialkyl ether - Ether - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Organooxygen compound - Organonitrogen 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