Compound Identification
SMILES
CC1=C(N=NC2=CC=C(Br)C=C2)C(=O)N(C2=CC=CC=C2)C(=S)N1C1=NC2=CC=CC=C2S1
InChIKey
InChIKey=LNNXZCAJPHFRJU-UHFFFAOYSA-N
Formula
C24H16BrN5OS2
Mass
534.45
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
Bromobenzenes Pyrimidones Pyrimidinethiones Aryl bromides Hydropyrimidines Vinylogous amides Heteroaromatic compounds Thiazoles Lactams Azo compounds Thioureas Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Organic oxides Hydrocarbon derivatives Organobromides Organooxygen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,3-benzothiazole - Halobenzene - Pyrimidinethione - Pyrimidone - Bromobenzene - Monocyclic benzene moiety - Aryl bromide - Pyrimidine - Benzenoid - Hydropyrimidine - Aryl halide - Vinylogous amide - Thiazole - Heteroaromatic compound - Azole - Thiourea - Lactam - Azo compound - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organooxygen compound - Organosulfur compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organohalogen compound - Organobromide - 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