Structure Information
Structure

Compound Identification

SMILES

CC1=CC(C)=C2N=C(NC(=O)C3=CC=C(S3)[N+]([O-])=O)SC2=C1

InChIKey

InChIKey=UHHPFQNPZFKRCL-UHFFFAOYSA-N

Formula

C14H11N3O3S2

Mass

333.38

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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 - Thiophene carboxamide - Nitroaromatic compound - Thiophene carboxylic acid or derivatives - 2,5-disubstituted thiophene - Benzenoid - Heteroaromatic compound - Thiophene - Azole - Thiazole - C-nitro compound - Organic nitro compound - Secondary carboxylic acid amide - Carboxamide group - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Carboxylic acid derivative - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Organic zwitterion - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen 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

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