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Structure Information
Structure

Compound Identification

SMILES

CC1=NC2=C(C(C)=C1)C(=O)N(C1=CC=C(Br)C=C1)C(=S)N2C1=CC=C(Br)C=C1

InChIKey

InChIKey=JRFSPKLIAIVCJA-UHFFFAOYSA-N

Formula

C21H15Br2N3OS

Mass

517.24

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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 - Methylpyridine - Bromobenzene - Halobenzene - Pyrimidone - Pyrimidinethione - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Benzenoid - Pyridine - Pyrimidine - Heteroaromatic compound - Vinylogous amide - Lactam - Thiourea - Azacycle - Organooxygen compound - Organonitrogen compound - Organobromide - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organosulfur compound - Organic nitrogen compound - 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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