Structure Information
Structure

Compound Identification

SMILES

CC1=CN2C(=O)C3=C(N=C2C=C1)N(CC1=CC=CO1)C(=N)C(=C3)C#N

InChIKey

InChIKey=IFDDKXIRNYVOOD-UHFFFAOYSA-N

Formula

C18H13N5O2

Mass

331.335

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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 - Pyrimidone - Methylpyridine - Pyridine - Pyrimidine - Imidolactam - Furan - Vinylogous amide - Heteroaromatic compound - Lactam - Oxacycle - Azacycle - Nitrile - Carbonitrile - Cyanide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - 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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