Compound Identification
SMILES
COC(=O)C(=CC1=NC2=C(S1)C=C(C=C2)[N+]([O-])=O)C(C(=O)OC)=C1CCCN1C
InChIKey
InChIKey=COICVVAABJJKEZ-UHFFFAOYSA-N
Formula
C19H19N3O6S
Mass
417.44
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
Nitroaromatic compounds Fatty acid esters Benzenoids Dicarboxylic acids and derivatives N-alkylpyrrolidines Vinylogous amides Thiazoles Enoate esters Methyl esters Heteroaromatic compounds Trialkylamines Amino acids and derivatives Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Enamines Organic salts Carbonyl compounds Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,3-benzothiazole - Nitroaromatic compound - Fatty acid ester - N-alkylpyrrolidine - Benzenoid - Fatty acyl - Dicarboxylic acid or derivatives - Methyl ester - Thiazole - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Azole - Pyrrolidine - Heteroaromatic compound - Vinylogous amide - Tertiary aliphatic amine - C-nitro compound - Carboxylic acid ester - Amino acid or derivatives - Tertiary amine - Organic nitro compound - Carboxylic acid derivative - Azacycle - Enamine - Organic 1,3-dipolar compound - Organic oxoazanium - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic salt - Organic nitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Organonitrogen compound - Organooxygen compound - Carbonyl group - Amine - 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