Structure Information
Structure

Compound Identification

SMILES

CC(C)CCN[C@@H]1CCN(C1)C(=O)N1CC[C@@H](C1)N(C)C(=O)C1=CC=C(S1)C1=CC=C(C=C1)C(F)(F)F

InChIKey

InChIKey=JSHFRYXNYCGMOK-YADHBBJMSA-N

Formula

C27H35F3N4O2S

Mass

536.66

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Trifluoromethylbenzenes

Intermediate Tree Nodes

Not available

Direct Parent

Trifluoromethylbenzenes

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Trifluoromethylbenzene - 2-heteroaryl carboxamide - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine-1-carboxamide - Thiophene carboxylic acid or derivatives - Thiophene carboxamide - 2,5-disubstituted thiophene - Heteroaromatic compound - Pyrrolidine - Tertiary carboxylic acid amide - Thiophene - Amino acid or derivatives - Carboxamide group - Urea - Carboxylic acid derivative - Secondary aliphatic amine - Azacycle - Secondary amine - Organoheterocyclic compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Alkyl halide - Alkyl fluoride - Organic oxygen compound - Carbonyl group - Organic oxide - Hydrocarbon derivative - Amine - Organic nitrogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as trifluoromethylbenzenes. These are organofluorine compounds that contain a benzene ring substituted with one or more trifluoromethyl groups.

External Descriptors

Not available

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