Structure Information
Structure

Compound Identification

SMILES

O=S(=O)(CC1=CC=C(C=C1)C#N)C1=CC=CC(=C1)C(CC#N)N1C=C(C=N1)C1=C2C=CNC2=NC=N1

InChIKey

InChIKey=OYKOFGIGGKUSAT-UHFFFAOYSA-N

Formula

C26H19N7O2S

Mass

493.55

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Pyrrolopyrimidines

Subclass

Pyrrolo[2,3-d]pyrimidines

Intermediate Tree Nodes

Not available

Direct Parent

Pyrrolo[2,3-d]pyrimidines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Pyrrolo[2,3-d]pyrimidine - Benzenesulfonyl group - Benzonitrile - Monocyclic benzene moiety - Pyrimidine - Benzenoid - Azole - Pyrazole - Heteroaromatic compound - Pyrrole - Sulfonyl - Sulfone - Carbonitrile - Nitrile - Azacycle - Organosulfur compound - Organonitrogen compound - Organic nitrogen compound - Cyanide - Organic oxide - Hydrocarbon derivative - Organic oxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as pyrrolo[2,3-d]pyrimidines. These are aromatic heteropolycyclic compounds containing a pyrrolo[2,3-d]pyrimidine ring system, which is an pyrrolopyrimidine isomers having the 3 ring nitrogen atoms at the 1-, 5-, and 7-positions.

External Descriptors

Not available

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