Structure Information
Structure

Compound Identification

SMILES

NC1=C(SCC(=O)C2=CC=C(C=C2)N=[N+]=[N-])C=NC(=O)N1

InChIKey

InChIKey=SPDTXCFSGOHJQR-UHFFFAOYSA-N

Formula

C12H10N6O2S

Mass

302.31

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic oxygen compounds

Class

Organooxygen compounds

Subclass

Carbonyl compounds

Intermediate Tree Nodes

Ketones - Aryl ketones - Phenylketones

Direct Parent

Alkyl-phenylketones

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Alkyl-phenylketone - Aryl thioether - Benzoyl - Aryl alkyl ketone - Phenylazide - Aminopyrimidine - Alkylarylthioether - Pyrimidone - Monocyclic benzene moiety - Hydropyrimidine - Benzenoid - Pyrimidine - Heteroaromatic compound - Azo compound - Azo imide - Azacycle - Organoheterocyclic compound - Sulfenyl compound - Thioether - Organosulfur compound - Organonitrogen compound - Organic salt - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organic zwitterion - Primary amine - Organic oxide - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as alkyl-phenylketones. These are aromatic compounds containing a ketone substituted by one alkyl group, and a phenyl group.

External Descriptors

Not available

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