Compound Identification
SMILES
COC(=O)CC1=NN(C(=O)C1C(C)=NCCO)C1=NC2=CC=CC=C2S1
InChIKey
InChIKey=UIBNLPDWWFWTLI-UHFFFAOYSA-N
Formula
C17H18N4O4S
Mass
374.42
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
Pyrazolones Benzenoids Thiazoles Secondary ketimines Azomethines Heteroaromatic compounds Methyl esters Alkanolamines Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Monocarboxylic acids and derivatives Carbonyl compounds Organopnictogen compounds Hydrocarbon derivatives Organic oxides Primary alcohols
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,3-benzothiazole - Pyrazolinone - Benzenoid - Azole - Azomethine - Heteroaromatic compound - Pyrazoline - Secondary ketimine - Methyl ester - Thiazole - Carboxylic acid ester - Ketimine - Alkanolamine - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Hydrocarbon derivative - Imine - Organic oxide - Alcohol - Carbonyl group - Organonitrogen compound - Organooxygen compound - Primary alcohol - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - 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