Structure Information
Structure

Compound Identification

SMILES

BrC1=CC=CC(NC2=NC=NC3=CN=C(CC(=O)\C=C\C(=O)NCCCN4CCOCC4)C=C23)=C1

InChIKey

InChIKey=JBULJGRFCMVTLA-AATRIKPKSA-N

Formula

C25H27BrN6O3

Mass

539.434

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Pyridopyrimidines

Subclass

Pyrido[3,4-d]pyrimidines

Intermediate Tree Nodes

Not available

Direct Parent

Pyrido[3,4-d]pyrimidines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Pyrido[3,4-d]pyrimidine - Aniline or substituted anilines - Halobenzene - Aminopyrimidine - Bromobenzene - Oxazinane - Pyridine - Pyrimidine - N-acyl-amine - Monocyclic benzene moiety - Aryl halide - Aryl bromide - Imidolactam - Benzenoid - Morpholine - Acryloyl-group - Alpha,beta-unsaturated ketone - Enone - Heteroaromatic compound - Amino acid or derivatives - Carboxamide group - Tertiary aliphatic amine - Tertiary amine - Ketone - Secondary carboxylic acid amide - Secondary amine - Oxacycle - Azacycle - Carboxylic acid derivative - Dialkyl ether - Ether - Amine - Carbonyl group - Organobromide - Organonitrogen compound - Hydrocarbon derivative - Organohalogen compound - Organooxygen compound - Organic nitrogen compound - Organic oxide - Organic oxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as pyrido[3,4-d]pyrimidines. These are compounds containing the pyrido[3,4-d]pyrimidine ring system, which is a pyridopyrimidine isomer with three ring nitrogen atoms at the 1-, 3-, and 7- position.

External Descriptors

Not available

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