Structure Information
Structure

Compound Identification

SMILES

COC1=C(NC(=O)C2=C(F)C=C(C=C2)C(F)(F)F)C=CC(=C1)C1=NN(C2=C1C(N)=NC=N2)C1=CC=C(CN[C@@H](CC2C=NC=N2)C(O)=O)C=C1

InChIKey

InChIKey=MJNMDRUMHWXKDF-KUXBLMNESA-N

Formula

C33H27F4N9O4

Mass

689.632

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Anilides

Intermediate Tree Nodes

Aromatic anilides

Direct Parent

Benzanilides

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Benzanilide - Phenylpyrazole - Halobenzoic acid or derivatives - 2-halobenzoic acid or derivatives - Alpha-amino acid - Trifluoromethylbenzene - Alpha-amino acid or derivatives - L-alpha-amino acid - Benzoic acid or derivatives - Benzamide - Pyrazolopyrimidine - Pyrazolo[3,4-d]pyrimidine - Methoxyaniline - Phenoxy compound - Benzoyl - Benzylamine - Phenylmethylamine - Methoxybenzene - Imidazolyl carboxylic acid derivative - Phenol ether - Anisole - Alkyl aryl ether - Aminopyrimidine - Aralkylamine - Halobenzene - Fluorobenzene - Pyrimidine - Aryl halide - Aryl fluoride - Imidolactam - Heteroaromatic compound - Azole - Vinylogous halide - Imidazole - Pyrazole - Amino acid or derivatives - Amino acid - Carboxamide group - Secondary carboxylic acid amide - Monocarboxylic acid or derivatives - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Carboxylic acid - Secondary aliphatic amine - Ether - Secondary amine - Organonitrogen compound - Alkyl fluoride - Organooxygen compound - Organic nitrogen compound - Alkyl halide - Organofluoride - Organohalogen compound - Carbonyl group - Organic oxygen compound - Amine - Primary amine - Organic oxide - Hydrocarbon derivative - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as benzanilides. These are aromatic compounds containing an anilide group in which the carboxamide group is substituted with a benzene ring. They have the general structure RNC(=O)R', where R,R'= benzene.

External Descriptors

Not available

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