Compound Identification
SMILES
CN(C)C1=C(C=C(C=NC2=CC3=C(C=C2)N=C(SCC2=CC=C(Br)C=C2)S3)C=C1)[N+]([O-])=O
InChIKey
InChIKey=OYHCYIJJLHATFN-UHFFFAOYSA-N
Formula
C23H19BrN4O2S2
Mass
527.46
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
Nitrobenzenes Aniline and substituted anilines Dialkylarylamines Nitroaromatic compounds Alkylarylthioethers Bromobenzenes Aryl bromides Heteroaromatic compounds Thiazoles Shiff bases Organic oxoazanium compounds Propargyl-type 1,3-dipolar organic compounds Sulfenyl compounds Azacyclic compounds Organic oxides Hydrocarbon derivatives Organic salts Organobromides Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,3-benzothiazole - Nitrobenzene - Aryl thioether - Nitroaromatic compound - Aniline or substituted anilines - Dialkylarylamine - Tertiary aliphatic/aromatic amine - Bromobenzene - Halobenzene - Alkylarylthioether - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Benzenoid - Azole - Heteroaromatic compound - Thiazole - C-nitro compound - Organic nitro compound - Shiff base - Tertiary amine - Sulfenyl compound - Thioether - Organic 1,3-dipolar compound - Aldimine - Azacycle - Propargyl-type 1,3-dipolar organic compound - Organic oxoazanium - Allyl-type 1,3-dipolar organic compound - Organic nitrogen compound - Organic salt - Organohalogen compound - Organobromide - Imine - Organonitrogen compound - Amine - Hydrocarbon derivative - Organic oxide - Organosulfur compound - Organic oxygen compound - 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