Structure Information
Structure

Compound Identification

SMILES

COC1=CC(=CC(OC)=C1OC)N(CC#C)CC1=CN=C2N=C(N)N=C(N)C2=C1C

InChIKey

InChIKey=HWTHGASACLWVQR-UHFFFAOYSA-N

Formula

C21H24N6O3

Mass

408.462

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Pyridopyrimidines

Subclass

Pyrido[2,3-d]pyrimidines

Intermediate Tree Nodes

Not available

Direct Parent

Pyrido[2,3-d]pyrimidines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Pyrido[2,3-d]pyrimidine - Aminophenyl ether - Methoxyaniline - Phenoxy compound - Anisole - Phenol ether - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Methoxybenzene - Aniline or substituted anilines - Alkyl aryl ether - Aminopyrimidine - Methylpyridine - Aralkylamine - Pyridine - Pyrimidine - Monocyclic benzene moiety - Benzenoid - Imidolactam - Heteroaromatic compound - Tertiary amine - Ether - Acetylide - Azacycle - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Primary amine - Hydrocarbon derivative - Organopnictogen compound - Organic oxygen compound - Amine - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as pyrido[2,3-d]pyrimidines. These are compounds containing the pyrido[2,3-d]pyrimidine ring system, which is a pyridopyrimidine isomer with three ring nitrogen atoms at the 1-, 3-, and 8- position.

External Descriptors

Not available

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