Structure Information
Structure

Compound Identification

SMILES

COC(=O)C1=C(C)N(N)C2=C1C(=O)N(C(C)=N2)C1=CC=C(Cl)C=C1

InChIKey

InChIKey=KYZIFUKUNJJHTF-UHFFFAOYSA-N

Formula

C16H15ClN4O3

Mass

346.77

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Pyrrolopyrimidines

Subclass

Pyrrolo[2,3-d]pyrimidines

Intermediate Tree Nodes

Not available

Direct Parent

Pyrrolo[2,3-d]pyrimidines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Pyrrolo[2,3-d]pyrimidine - Pyrrole-3-carboxylic acid or derivatives - Chlorobenzene - Halobenzene - Pyrimidone - Monocyclic benzene moiety - Benzenoid - Substituted pyrrole - Aryl chloride - Aryl halide - Pyrimidine - Heteroaromatic compound - Vinylogous amide - Methyl ester - Pyrrole - Carboxylic acid ester - Lactam - Carboxylic acid derivative - Azacycle - Organochloride - Organohalogen compound - Organic oxide - Organic nitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as pyrrolo[2,3-d]pyrimidines. These are aromatic heteropolycyclic compounds containing a pyrrolo[2,3-d]pyrimidine ring system, which is an pyrrolopyrimidine isomers having the 3 ring nitrogen atoms at the 1-, 5-, and 7-positions.

External Descriptors

Not available

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