Structure Information
Structure

Compound Identification

SMILES

NC1=NC(=O)C(N(CCSCCO)C=O)=C(N)N1

InChIKey

InChIKey=XLGNECVZBPNPAC-UHFFFAOYSA-N

Formula

C9H15N5O3S

Mass

273.31

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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

Pyrimidones

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Aminopyrimidine - Pyrimidone - Hydropyrimidine - Tertiary carboxylic acid amide - Heteroaromatic compound - Vinylogous amide - Amino acid or derivatives - Carboxamide group - Sulfenyl compound - Thioether - Azacycle - Dialkylthioether - Carboxylic acid derivative - Hydrocarbon derivative - Primary alcohol - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Primary amine - Amine - Carbonyl group - Organic nitrogen compound - Alcohol - Organic oxide - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as pyrimidones. These are compounds that contain a pyrimidine ring, which bears a ketone. 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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