Structure Information
Structure

Compound Identification

SMILES

CN(C(=O)C=C)C1=NC=C2N=CN=C(NC3=CC(Br)=CC=C3)C2=C1

InChIKey

InChIKey=RCWLMTHCAVCUFY-UHFFFAOYSA-N

Formula

C17H14BrN5O

Mass

384.237

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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 - Aminopyrimidine - Halobenzene - Bromobenzene - Aryl bromide - Pyridine - Pyrimidine - Benzenoid - Imidolactam - Aryl halide - Monocyclic benzene moiety - Acrylic acid or derivatives - Heteroaromatic compound - Tertiary carboxylic acid amide - Carboxamide group - Carboxylic acid derivative - Azacycle - Amine - Organohalogen compound - Organobromide - Organonitrogen compound - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen 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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