Compound Identification
SMILES
CC(=O)[C@@H]1[C@H](C(C#N)C(SCC(=O)NC2=NC3=CC=CC=C3S2)=NC1=C)C1=CC=CC=C1[N+]([O-])=O
InChIKey
InChIKey=MAUDSDLPOQQETF-JLYBBMSXSA-N
Formula
C24H19N5O4S2
Mass
505.57
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 N-arylamides Nitroaromatic compounds Tetrahydropyridines Imidothiolactones Thiazoles Heteroaromatic compounds Secondary carboxylic acid amides Ketones Azacyclic compounds Sulfenyl compounds Propargyl-type 1,3-dipolar organic compounds Nitriles Organic oxoazanium compounds Organic salts Hydrocarbon derivatives Organic zwitterions Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,3-benzothiazole - Nitrobenzene - Nitroaromatic compound - N-arylamide - Tetrahydropyridine - Monocyclic benzene moiety - Hydropyridine - Benzenoid - Imidothiolactone - Azole - Thiazole - Heteroaromatic compound - Organic nitro compound - Carboxamide group - Ketone - C-nitro compound - Secondary carboxylic acid amide - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Allyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Azacycle - Carbonitrile - Nitrile - Organic oxoazanium - Sulfenyl compound - Organic zwitterion - Organic oxygen compound - Organic salt - Organic oxide - Cyanide - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - Hydrocarbon derivative - Carbonyl group - 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