Compound Identification
SMILES
O=C(\C(=C\NC1=CC=CC2=NSN=C12)C#N)C1=CC=CS1
InChIKey
InChIKey=GEIXYXQVRNZERM-CMDGGOBGSA-N
Formula
C14H8N4OS2
Mass
312.37
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
Aryl ketones Benzenoids Alpha-branched alpha,beta-unsaturated ketones Vinylogous amides Thiophenes Thiadiazoles Heteroaromatic compounds Enones Acryloyl compounds Nitriles Enamines Azacyclic compounds Allylamines Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2,1,3-benzothiadiazole - Aryl ketone - Benzenoid - Alpha-branched alpha,beta-unsaturated-ketone - Acryloyl-group - Azole - Enone - Thiadiazole - Thiophene - Alpha,beta-unsaturated ketone - Vinylogous amide - Heteroaromatic compound - Ketone - Nitrile - Carbonitrile - Enamine - Azacycle - Allylamine - Organic oxygen compound - Organic nitrogen compound - Amine - Organooxygen compound - Organonitrogen compound - Cyanide - Organic oxide - Hydrocarbon derivative - 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