Structure Information
Structure

Compound Identification

SMILES

CCN(CC)CCCNC(=O)\C=C\C(=O)CC1=NC=C2N=CN=C(NC3=CC(Br)=CC=C3)C2=C1

InChIKey

InChIKey=XBUGBTZCVMDYNI-MDZDMXLPSA-N

Formula

C25H29BrN6O2

Mass

525.451

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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 - Bromobenzene - Aminopyrimidine - Halobenzene - Pyridine - Pyrimidine - Aryl halide - Monocyclic benzene moiety - Aryl bromide - Imidolactam - Benzenoid - N-acyl-amine - Acryloyl-group - Enone - Alpha,beta-unsaturated ketone - Heteroaromatic compound - Amino acid or derivatives - Ketone - Tertiary aliphatic amine - Secondary carboxylic acid amide - Tertiary amine - Carboxamide group - Azacycle - Carboxylic acid derivative - Secondary amine - Organic nitrogen compound - Organohalogen compound - Carbonyl group - Organobromide - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Amine - 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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