Structure Information
Structure

Compound Identification

SMILES

CCCCNC(=O)C1=CC(N2N=C(CCCC)C(CC3=C(Cl)C=C(C=C3)C3=CC=CC=C3S(=O)(=O)NC(=O)C3=CC=CC=C3F)=C2C#N)=C(C=C1)C(F)(F)F

InChIKey

InChIKey=SOHJHMIXSBCKOX-UHFFFAOYSA-N

Formula

C40H36ClF4N5O4S

Mass

794.26

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Biphenyls and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Chlorinated biphenyls

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Chlorinated biphenyl - Phenylpyrazole - Trifluoromethylbenzene - 2-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzenesulfonamide - Benzenesulfonyl group - Benzamide - Benzoic acid or derivatives - Benzoyl - Halobenzene - Chlorobenzene - Fluorobenzene - Aryl halide - Aryl fluoride - Aryl chloride - Vinylogous halide - Aminosulfonyl compound - Azole - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Pyrazole - Heteroaromatic compound - Secondary carboxylic acid amide - Carboxamide group - Nitrile - Carbonitrile - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Organochloride - Organosulfur compound - Organooxygen compound - Alkyl halide - Alkyl fluoride - Organonitrogen compound - Organofluoride - Hydrocarbon derivative - Organic oxide - Cyanide - Organic oxygen compound - Organic nitrogen compound - Organohalogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as chlorinated biphenyls. These are organic compounds containing at least one chlorine atom attached to either benzene ring of the biphenyl moiety.

External Descriptors

Not available

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