Structure Information
Structure

Compound Identification

SMILES

COC1=C(OC)C=C(C=C1)C(=O)CSC1=NN=C(N1C1=CC=C(Br)C=C1)C1=CC=NC=C1

InChIKey

InChIKey=CGPMLZNTOHMALU-UHFFFAOYSA-N

Formula

C23H19BrN4O3S

Mass

511.39

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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 - Phenyltriazole - Phenyl-1,2,4-triazole - Pyridyltriazole - Pyridyl-1,2,4-triazole - O-dimethoxybenzene - Dimethoxybenzene - Anisole - Phenoxy compound - Aryl thioether - Benzoyl - Phenol ether - Methoxybenzene - Aryl alkyl ketone - Alkyl aryl ether - Bromobenzene - Halobenzene - Alkylarylthioether - Benzenoid - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Pyridine - Heteroaromatic compound - 1,2,4-triazole - Azole - Triazole - Ether - Azacycle - Organoheterocyclic compound - Sulfenyl compound - Thioether - Organobromide - Organohalogen compound - Organic nitrogen compound - Organic oxide - Organonitrogen compound - Organosulfur compound - Hydrocarbon derivative - 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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