Compound Identification
SMILES
CC1=C(C)C=C(NC2=NC(=O)[C@H](CC(=O)NC3=CC=CC(=C3)C(F)(F)F)S2)C=C1
InChIKey
InChIKey=NMEPPSPSGYTKAV-INIZCTEOSA-N
Formula
C20H18F3N3O2S
Mass
421.44
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Trifluoromethylbenzenes
-
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
Anilides o-Xylenes Aniline and substituted anilines N-arylamides Thiazolines Secondary carboxylic acid amides Isothioureas N-acylimines Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Carbonyl compounds Amines Organofluorides Alkyl fluorides Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Trifluoromethylbenzene - Anilide - N-arylamide - Aniline or substituted anilines - O-xylene - Xylene - Meta-thiazoline - Carboxamide group - Isothiourea - Secondary carboxylic acid amide - N-acylimine - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Organic oxygen compound - Amine - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Alkyl halide - Organic nitrogen compound - Alkyl fluoride - Carbonyl group - Organic oxide - Hydrocarbon derivative - 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