Structure Information
Structure

Compound Identification

SMILES

CC(C)SCCSC1=NC2=C(S1)C=C(NC(=O)C1=CC=C(S1)[N+]([O-])=O)C=C2

InChIKey

InChIKey=WEPNMQAHXMJHDE-UHFFFAOYSA-N

Formula

C17H17N3O3S4

Mass

439.58

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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

1,3-benzothiazole - 2-nitrothiophene - Nitrothiophene - 2-heteroaryl carboxamide - Aryl thioether - Nitroaromatic compound - Thiophene carboxamide - Thiophene carboxylic acid or derivatives - 2,5-disubstituted thiophene - Alkylarylthioether - Benzenoid - Azole - Thiazole - Thiophene - Heteroaromatic compound - Organic nitro compound - C-nitro compound - Secondary carboxylic acid amide - Carboxamide group - Organic 1,3-dipolar compound - Azacycle - Dialkylthioether - Carboxylic acid derivative - Propargyl-type 1,3-dipolar organic compound - Organic oxoazanium - Allyl-type 1,3-dipolar organic compound - Thioether - Sulfenyl compound - Organosulfur compound - Organic salt - Organonitrogen compound - Organic oxygen compound - Organic oxide - Organic nitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic zwitterion - 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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