Structure Information
Structure

Compound Identification

SMILES

COCCCNC1=NC(NCCCOC)=C(N=NC2=C(C=C(C=C2)S(=O)(=O)CCOS(O)(=O)=O)S(O)(=O)=O)C(C)=C1C#N

InChIKey

InChIKey=XSKIDHVJVYFGJK-UHFFFAOYSA-N

Formula

C23H32N6O11S3

Mass

664.72

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Benzenesulfonic acids and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Benzenesulfonic acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Benzenesulfonate - Arylsulfonic acid or derivatives - 1-sulfo,2-unsubstituted aromatic compound - Benzenesulfonyl group - 3-pyridinecarbonitrile - Aminopyridine - Secondary aliphatic/aromatic amine - Methylpyridine - Imidolactam - Sulfuric acid ester - Alkyl sulfate - Sulfate-ester - Pyridine - Sulfuric acid monoester - Sulfonyl - Organic sulfuric acid or derivatives - Sulfone - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Heteroaromatic compound - Azo compound - Dialkyl ether - Ether - Carbonitrile - Nitrile - Azacycle - Secondary amine - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organic oxide - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Cyanide - Amine - Organic nitrogen compound - Organic oxygen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as benzenesulfonic acids and derivatives. These are organic compounds containing a sulfonic acid or a derivative thereof that is linked to a benzene ring.

External Descriptors

Not available

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