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
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Trifluoromethylbenzenes
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Trifluoromethylbenzenes
Intermediate Tree Nodes
Not available
Direct Parent
Trifluoromethylbenzenes
Alternative Parents
Thiophene carboxamides Pyrrolidinecarboxamides 2-heteroaryl carboxamides 2,5-disubstituted thiophenes Tertiary carboxylic acid amides Heteroaromatic compounds Ureas Amino acids and derivatives Dialkylamines Azacyclic compounds Organofluorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl fluorides
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