Compound Identification
SMILES
CSC1=CC=CC2=C1N=C(N2)[C@@H]1CCCN1C(=O)C1=C(SC(C)=N1)C1=CC(=CC=C1)C(F)(F)F
InChIKey
InChIKey=KGKZRTMWKKDPKH-KRWDZBQOSA-N
Formula
C24H21F3N4OS2
Mass
502.57
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
Benzimidazoles Thiophenol ethers Thiazolecarboxamides 2,4,5-trisubstituted thiazoles 2-heteroaryl carboxamides N-acylpyrrolidines Alkylarylthioethers Tertiary carboxylic acid amides Heteroaromatic compounds Imidazoles Sulfenyl compounds Azacyclic compounds Organofluorides Organooxygen compounds Organonitrogen compounds Alkyl fluorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Trifluoromethylbenzene - Benzimidazole - 2-heteroaryl carboxamide - 2,4,5-trisubstituted 1,3-thiazole - Aryl thioether - N-acylpyrrolidine - Thiazolecarboxamide - Thiazolecarboxylic acid or derivatives - Thiophenol ether - Alkylarylthioether - Azole - Imidazole - Pyrrolidine - Tertiary carboxylic acid amide - Heteroaromatic compound - Thiazole - Carboxamide group - Organoheterocyclic compound - Sulfenyl compound - Azacycle - Thioether - Carboxylic acid derivative - Hydrocarbon derivative - Organofluoride - Organohalogen compound - Organic oxide - Alkyl fluoride - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Organic oxygen compound - Organosulfur compound - Alkyl halide - Aromatic heteropolycyclic 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