Compound Identification
SMILES
CC1=CC(C(=O)CCC(=O)OCC(=O)NC2=CC=CC3=NSN=C23)=C(C)S1
InChIKey
InChIKey=KZOIRRYFGLAULE-UHFFFAOYSA-N
Formula
C18H17N3O4S2
Mass
403.47
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzothiadiazoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzothiadiazoles
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzothiadiazoles
Alternative Parents
N-arylamides Gamma-keto acids and derivatives Aryl alkyl ketones 2,3,5-trisubstituted thiophenes Fatty acid esters Benzenoids Thiadiazoles Heteroaromatic compounds Secondary carboxylic acid amides Carboxylic acid esters Monocarboxylic acids and derivatives Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2,1,3-benzothiadiazole - Gamma-keto acid - N-arylamide - 2,3,5-trisubstituted thiophene - Aryl ketone - Aryl alkyl ketone - Fatty acid ester - Fatty acyl - Benzenoid - Keto acid - Heteroaromatic compound - Azole - Thiophene - Thiadiazole - Carboxamide group - Secondary carboxylic acid amide - Carboxylic acid ester - Ketone - Azacycle - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organic oxygen compound - Organonitrogen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzothiadiazoles. These are heterocyclic aromatic compounds containing a benzene ring fused to a thiadiazole ring. Thiadiazole is a five-membered aromatic heterocycle made up of one sulfur atom and two nitrogen atoms.
External Descriptors
Not available