Structure Information
Structure

Compound Identification

SMILES

CCCC[NH+](CCCC)CC1=CN2C(S1)=NC(C(=O)NCC1=CC(Cl)=C(Cl)C=C1)=C(O)C2=O

InChIKey

InChIKey=KGOFZZXLOVZBPK-UHFFFAOYSA-O

Formula

C23H29Cl2N4O3S

Mass

512.47

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Diazines

Subclass

Pyrimidines and pyrimidine derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Pyrimidinecarboxylic acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Pyrimidine-6-carboxylic acid or derivatives - 2-heteroaryl carboxamide - 1,2-dichlorobenzene - Chlorobenzene - Halobenzene - Pyrimidone - Aralkylamine - Hydroxypyrimidine - Aryl halide - Benzenoid - Monocyclic benzene moiety - Aryl chloride - Vinylogous acid - Azole - Heteroaromatic compound - Thiazole - Quaternary ammonium salt - Tertiary aliphatic amine - Secondary carboxylic acid amide - Carboxamide group - Lactam - Carboxylic acid derivative - Azacycle - Organohalogen compound - Organic oxide - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organochloride - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Organic cation - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as pyrimidinecarboxylic acids and derivatives. These are compounds containing a pyrimidine ring which bears a carboxylic acid group (or a derivative thereof).

External Descriptors

Not available

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