Structure Information
Structure

Compound Identification

SMILES

CCC1=C(C=C2C(=C1)C(=O)OCS2(=O)=O)C(=O)N=C(N)N

InChIKey

InChIKey=JKQJZGUVWWRZNR-UHFFFAOYSA-N

Formula

C12H13N3O5S

Mass

311.31

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic nitrogen compounds

Class

Organonitrogen compounds

Subclass

Guanidines

Intermediate Tree Nodes

Not available

Direct Parent

Acylguanidines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Acylguanidine - 1,3-benzooxathiin - 1,3-oxathiin - Benzenoid - Monothioacetal - Sulfone - Carboxylic acid ester - Lactone - Organoheterocyclic compound - Carboximidamide - Oxacycle - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Hydrocarbon derivative - Organooxygen compound - Organic oxide - Organic oxygen compound - Organopnictogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as acylguanidines. These are n-acylated derivatives of guanidines.

External Descriptors

Not available

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