Structure Information
Structure

Compound Identification

SMILES

CCC1=CN=C(C=C1)C(=O)OC1CN(C)C[N+]1([O-])C1=NC=C(S1)S(=O)(=O)CC

InChIKey

InChIKey=AMUBBJRJMCPFJL-UHFFFAOYSA-N

Formula

C17H22N4O5S2

Mass

426.51

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Pyridines and derivatives

Subclass

Pyridinecarboxylic acids and derivatives

Intermediate Tree Nodes

Pyridinecarboxylic acids - Pyridine-2-carboxylic acids

Direct Parent

5-alkyl-2-carboxypyrimidines

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

5-alkyl-2-carboxypyrimidine - 2,5-disubstituted 1,3-thiazole - Azole - Imidazolidine - Sulfone - Sulfonyl - Thiazole - Heteroaromatic compound - Carboxylic acid ester - Carboxylic acid derivative - Azacycle - Trisubstituted n-oxide - N-oxide - Organic oxygen compound - Amine - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Organic zwitterion - Organic salt - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as 5-alkyl-2-carboxypyrimidines. These are pyrimidine-2-carboxylic acids that carry an alkyl group at the 5-position of the pyridine ring.

External Descriptors

Not available

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