Structure Information
Structure

Compound Identification

SMILES

OCC1=CC=CC(=C1)C1=NC2=C(C=CN2C2CCNCC2)C(=N1)N1CCOCC1

InChIKey

InChIKey=IOBPQMXNKOPXNC-UHFFFAOYSA-N

Formula

C22H27N5O2

Mass

393.491

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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 - Benzyl alcohol - Dialkylarylamine - Aminopyrimidine - Monocyclic benzene moiety - Morpholine - Oxazinane - Piperidine - Pyrimidine - Substituted pyrrole - Benzenoid - Imidolactam - Heteroaromatic compound - Pyrrole - Tertiary amine - Secondary amine - Oxacycle - Azacycle - Secondary aliphatic amine - Dialkyl ether - Ether - Organic oxygen compound - Amine - Organonitrogen compound - Organooxygen compound - Aromatic alcohol - Organic nitrogen compound - Hydrocarbon derivative - Primary alcohol - Alcohol - 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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