Structure Information
Structure

Compound Identification

SMILES

CCN(CC)C1=CC=C(C=C1)C(=O)NC1=NC(=CS1)C1=CC(=CS1)[N+]([O-])=O

InChIKey

InChIKey=DDKFPDXURIMPOW-UHFFFAOYSA-N

Formula

C18H18N4O3S2

Mass

402.49

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Benzoic acids and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Aminobenzoic acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Aminobenzoic acid or derivatives - 3-nitrothiophene - Nitrothiophene - Benzamide - Nitroaromatic compound - Benzoyl - Tertiary aliphatic/aromatic amine - Aniline or substituted anilines - Dialkylarylamine - 2,4-disubstituted 1,3-thiazole - Azole - Heteroaromatic compound - Thiazole - Thiophene - Amino acid or derivatives - Carboxamide group - C-nitro compound - Secondary carboxylic acid amide - Organic nitro compound - Tertiary amine - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organoheterocyclic compound - Azacycle - Organic oxoazanium - Carboxylic acid derivative - Organic oxide - Organic nitrogen compound - Amine - Organonitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organic salt - Organic zwitterion - Organic oxygen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as aminobenzoic acids and derivatives. These are benzoic acids (or derivative thereof) containing an amine group attached to the benzene moiety.

External Descriptors

Not available

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