Compound Identification
SMILES
CCN1C(SC2=C1C(C)=C(Cl)C=C2)=NC(=O)C1=CC=C(S1)[N+]([O-])=O
InChIKey
InChIKey=UGBKUXFUGZPUGT-UHFFFAOYSA-N
Formula
C15H12ClN3O3S2
Mass
381.85
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
2-nitrothiophenes Thiophene carboxamides Nitroaromatic compounds 2,5-disubstituted thiophenes Aryl chlorides Benzenoids Thiazoles Heteroaromatic compounds Isothioureas Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Carboxylic acids and derivatives Organooxygen compounds Hydrocarbon derivatives Organic oxides Organic salts Organochlorides Organonitrogen compounds Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,3-benzothiazole - Nitrothiophene - 2-nitrothiophene - Thiophene carboxylic acid or derivatives - Thiophene carboxamide - Nitroaromatic compound - 2,5-disubstituted thiophene - Aryl chloride - Benzenoid - Aryl halide - Heteroaromatic compound - Thiazole - Thiophene - Azole - Isothiourea - Organic nitro compound - C-nitro compound - Carboxylic acid derivative - Azacycle - Organic oxoazanium - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organochloride - Organic oxygen compound - Organohalogen compound - Organic salt - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Organic cation - 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