Structure Information
Structure

Compound Identification

SMILES

CC(C)C1=CSC(CCC2=CC3=NC(SCC(N)=O)=C(\C=C\C(O)=O)C(=O)N3C=C2)=N1

InChIKey

InChIKey=KXPGNUWGXFRQEM-GQCTYLIASA-N

Formula

C21H22N4O4S2

Mass

458.55

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Pyridopyrimidines

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Pyridopyrimidines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Pyridopyrimidine - Aryl thioether - 2,4-disubstituted 1,3-thiazole - Pyrimidone - Alkylarylthioether - Pyridine - Pyrimidine - Vinylogous thioester - Heteroaromatic compound - Thiazole - Azole - Carboxamide group - Primary carboxylic acid amide - Lactam - Sulfenyl compound - Thioether - Azacycle - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - Organic oxygen compound - Carbonyl group - Organic oxide - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as pyridopyrimidines. These are compounds containing a pyridopyrimidine, which consists of a pyridine fused to a pyrimidine. Pyridine is 6-membered ring consisting of five carbon atoms and a nitrogen atom. Pyrimidine is a 6-membered ring consisting of four carbon atoms and two nitrogen centers at the 1- and 3- ring positions.

External Descriptors

Not available

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