Structure Information
Structure

Compound Identification

SMILES

COC(=O)CSC1=NN2C(N=C(C)C=C2C)=C1C#N

InChIKey

InChIKey=ROIBBPSPPLIWTK-UHFFFAOYSA-N

Formula

C12H12N4O2S

Mass

276.31

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Pyrazolopyrimidines

Subclass

Pyrazolo[1,5-a]pyrimidines

Intermediate Tree Nodes

Not available

Direct Parent

Pyrazolo[1,5-a]pyrimidines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Pyrazolo[1,5-a]pyrimidine - Aryl thioether - Alkylarylthioether - Pyrimidine - Azole - Pyrazole - Methyl ester - Heteroaromatic compound - Carboxylic acid ester - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Carbonitrile - Nitrile - Thioether - Sulfenyl compound - Azacycle - Organooxygen compound - Organonitrogen compound - Organosulfur compound - Cyanide - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Carbonyl group - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as pyrazolo[1,5-a]pyrimidines. These are aromatic heterocyclic compounds containing a pyrazolo[3,4-d]pyrimidine ring system, which consists of a pyrazole ring fused to and sharing exactly one nitrogen atom with a pyrimidine ring.

External Descriptors

Not available

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