Structure Information
Structure

Compound Identification

SMILES

[O-][N+](=O)C1=C(C=CC(=C1)C(F)(F)F)N1CCN(CC1)C(=S)NC(=O)C1=C(Cl)C=CC(Br)=C1

InChIKey

InChIKey=IGUMSHBWDDHGQA-UHFFFAOYSA-N

Formula

C19H15BrClF3N4O3S

Mass

551.76

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Diazinanes

Subclass

Piperazines

Intermediate Tree Nodes

Not available

Direct Parent

Phenylpiperazines

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Phenylpiperazine - N-arylpiperazine - Trifluoromethylbenzene - 2-halobenzoic acid or derivatives - 3-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Nitrobenzene - Benzoic acid or derivatives - Nitroaromatic compound - Tertiary aliphatic/aromatic amine - Aniline or substituted anilines - Dialkylarylamine - Benzoyl - Halobenzene - Chlorobenzene - Bromobenzene - Monocyclic benzene moiety - Aryl halide - Aryl chloride - Benzenoid - Aryl bromide - Vinylogous halide - Amino acid or derivatives - Organic nitro compound - Thiourea - Tertiary amine - C-nitro compound - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic zwitterion - Organic nitrogen compound - Amine - Alkyl halide - Organic salt - Alkyl fluoride - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Organic oxygen compound - Organobromide - Organochloride - Organofluoride - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as phenylpiperazines. These are compounds containing a phenylpiperazine skeleton, which consists of a piperazine bound to a phenyl group.

External Descriptors

Not available

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