Structure Information
Structure

Compound Identification

SMILES

C\C(N(CC1=CN=C(C)N=C1N)C=O)=C(\CCO)S\C=C\C(=O)C1=CC=CC=C1

InChIKey

InChIKey=IYLXFMHBICTCPI-KWKPKBFNSA-N

Formula

C21H24N4O3S

Mass

412.51

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Benzoyl derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Benzoyl derivatives

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Benzoyl - Aryl ketone - Aminopyrimidine - Vinylogous thioester - Imidolactam - Pyrimidine - Acryloyl-group - Heteroaromatic compound - Enone - Alpha,beta-unsaturated ketone - Tertiary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Ketone - Thioenolether - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Sulfenyl compound - Organonitrogen compound - Organic oxygen compound - Amine - Alcohol - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organosulfur compound - Primary alcohol - Primary amine - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as benzoyl derivatives. These are organic compounds containing an acyl moiety of benzoic acid with the formula (C6H5CO-).

External Descriptors

Not available

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