Structure Information
Structure

Compound Identification

SMILES

COC1=C(C=C(C=C1)N1C=NN=N1)C(=O)N(C)C[C@@H](CCN1CCCN(CC1)C1=NC2=CC=CC=C2N1CC1=CC=C(F)C=C1)C1=CC=C(F)C=C1

InChIKey

InChIKey=XPKYEEJEGYLCAT-SSEXGKCCSA-N

Formula

C39H41F2N9O2

Mass

705.815

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Azoles

Subclass

Tetrazoles

Intermediate Tree Nodes

Not available

Direct Parent

Phenyltetrazoles and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Phenyltetrazole - Methoxyaniline - Benzoic acid or derivatives - Benzimidazole - Benzamide - Methoxybenzene - Phenol ether - Dialkylarylamine - Benzoyl - Anisole - Phenoxy compound - Halobenzene - 1,4-diazepane - Aralkylamine - Diazepane - Fluorobenzene - Alkyl aryl ether - Aminoimidazole - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - N-substituted imidazole - Imidazole - Tertiary carboxylic acid amide - Heteroaromatic compound - Tertiary amine - Amino acid or derivatives - Carboxamide group - Tertiary aliphatic amine - Azacycle - Ether - Carboxylic acid derivative - Organonitrogen compound - Hydrocarbon derivative - Amine - Organic oxygen compound - Organooxygen compound - Organic oxide - Organic nitrogen compound - Organofluoride - Organohalogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as phenyltetrazoles and derivatives. These are compounds containing a phenyltetrazole skeleton, which consists of a tetrazole bound to a phenyl group.

External Descriptors

Not available

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