Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)C1=S(=O)=C2N=CC(=CN2C1)C(C)C

InChIKey

InChIKey=GCPIJKZOKJDMMD-UHFFFAOYSA-N

Formula

C12H16N2O3S

Mass

268.33

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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

Pyrimidinethiones

Alternative Parents

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

2-thiopyrimidine - Thiopyrimidine - Pyrimidinethione - Hydropyrimidine - 1,2-dihydropyrimidine - Thioketone-s-oxide - Carboxylic acid ester - Thioketone - Carboxylic acid derivative - Enamine - Monocarboxylic acid or derivatives - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carbonyl group - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Amine - Aliphatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as pyrimidinethiones. These are compounds containing a pyrimidine ring that bears a thioketone. 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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