Structure Information
Structure

Compound Identification

SMILES

CC(O)=O.COC1=C(NC(=O)C2=NC=CN=C2)C=CC(=C1)C1=NN(C2CCNCC2)C2=C1C(N)=NC=N2

InChIKey

InChIKey=OCJBISKJISAMLJ-UHFFFAOYSA-N

Formula

C24H27N9O4

Mass

505.539

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Anilides

Intermediate Tree Nodes

Not available

Direct Parent

Aromatic anilides

Alternative Parents

Molecular Framework

Not available

Substituents

Aromatic anilide - Phenylpyrazole - Pyrazine carboxylic acid or derivatives - Pyrazinecarboxamide - Pyrazolopyrimidine - Pyrazolo[3,4-d]pyrimidine - Methoxyaniline - Anisole - Phenol ether - 2-heteroaryl carboxamide - Phenoxy compound - Methoxybenzene - Alkyl aryl ether - Aminopyrimidine - Imidolactam - Piperidine - Pyrimidine - Pyrazine - Azole - Heteroaromatic compound - Pyrazole - Carboxamide group - Amino acid or derivatives - Secondary carboxylic acid amide - Secondary aliphatic amine - Organoheterocyclic compound - Carboxylic acid - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Ether - Secondary amine - Azacycle - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Carbonyl group - Amine - Organic oxide - Primary amine - Organic nitrogen compound - Organic oxygen compound - Aromatic heteropolycyclic compound

Description

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

External Descriptors

Not available

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