Structure Information
Structure

Compound Identification

SMILES

Cl.CCN(CC)CCN(C(=O)C1=CC(=CC=C1)[N+]([O-])=O)C1=NC2=C(S1)C=C(OC)C=C2

InChIKey

InChIKey=DXDJUOGPTDODEZ-UHFFFAOYSA-N

Formula

C21H25ClN4O4S

Mass

464.97

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzothiazoles

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Benzothiazoles

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Benzamide - Benzoic acid or derivatives - 1,3-benzothiazole - Nitrobenzene - Anisole - Nitroaromatic compound - Benzoyl - Phenol ether - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Azole - Tertiary carboxylic acid amide - Thiazole - Tertiary aliphatic amine - Organic nitro compound - Tertiary amine - Amino acid or derivatives - C-nitro compound - Carboxamide group - Azacycle - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organic oxoazanium - Ether - Carboxylic acid derivative - Organic salt - Organooxygen compound - Organic oxide - Organic oxygen compound - Amine - Hydrochloride - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen 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

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