Structure Information
Structure

Compound Identification

SMILES

COC1=C(C)C(CN2C(=O)\C(=C\C3=CC=C(N3)C(=O)N3CCN(CCO)CC3)C3=C2N=C(N)N=C3Cl)=NC=C1C

InChIKey

InChIKey=BYBBBVODVAVWRA-LDADJPATSA-N

Formula

C27H31ClN8O4

Mass

567.05

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Pyrrolopyrimidines

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Pyrrolopyrimidines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Pyrrolopyrimidine - 2-heteroaryl carboxamide - Pyrrole-2-carboxamide - Pyrrole-2-carboxylic acid or derivatives - Alkyl aryl ether - Aminopyrimidine - Halopyrimidine - N-alkylpiperazine - Methylpyridine - Pyrimidine - Pyridine - Piperazine - Substituted pyrrole - Aryl chloride - Imidolactam - 1,4-diazinane - Aryl halide - Tertiary carboxylic acid amide - Heteroaromatic compound - Pyrrole - 1,2-aminoalcohol - Amino acid or derivatives - Carboxamide group - Tertiary aliphatic amine - Lactam - Tertiary amine - Alkanolamine - Carboxylic acid derivative - Azacycle - Ether - Primary amine - Organic nitrogen compound - Amine - Organohalogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Alcohol - Primary alcohol - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as pyrrolopyrimidines. These are compounds containing a pyrrolopyrimidine moiety, which consists of a pyrrole ring fused to a pyrimidine. Pyrrole is 5-membered ring consisting of four carbon atoms and one 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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