Structure Information
Structure

Compound Identification

SMILES

COC1=C(Br)C=C(C=C1)[C@H]1C(C#N)=C(N)OC2=C1C(=O)NC(=S)N2

InChIKey

InChIKey=RHOCHWYVBBGFMS-JTQLQIEISA-N

Formula

C15H11BrN4O3S

Mass

407.24

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Pyranopyrimidines

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Pyranopyrimidines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Pyranopyridine - Pyranopyrimidine - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - 2-thiopyrimidine - Pyrimidinethione - Pyrimidone - Thiopyrimidine - Halobenzene - Bromobenzene - Benzenoid - Pyridine - Pyrimidine - Aryl bromide - Monocyclic benzene moiety - Aryl halide - Vinylogous amide - Vinylogous ester - Heteroaromatic compound - Ketene acetal or derivatives - Lactam - Thiourea - Oxacycle - Ether - Azacycle - Carbonitrile - Nitrile - Amine - Organic nitrogen compound - Organooxygen compound - Organosulfur compound - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Cyanide - Organohalogen compound - Organobromide - Organonitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as pyranopyrimidines. These are polycyclic aromatic compounds containing a pyran ring fused to a pyrimidine ring.

External Descriptors

Not available

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