Compound Identification
SMILES
OC(=O)C1=CN=C(SCC2=NC(=O)C3=C(N2)N=C(S3)N2CCC(CC2)OC2=CC=CC=C2C(F)(F)F)C=C1
InChIKey
InChIKey=GVIIVJAXEDVSLZ-UHFFFAOYSA-N
Formula
C24H20F3N5O4S2
Mass
563.57
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
Pyridinecarboxylic acids Phenoxy compounds Phenol ethers Dialkylarylamines Pyrimidones Alkyl aryl ethers Alkylarylthioethers 2-amino-1,3-thiazoles Piperidines Vinylogous amides Heteroaromatic compounds Amino acids Carboxylic acids Azacyclic compounds Sulfenyl compounds Organic oxides Alkyl fluorides Organofluorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Trifluoromethylbenzene - Pyridine carboxylic acid - Pyridine carboxylic acid or derivatives - Phenoxy compound - Aryl thioether - Phenol ether - Dialkylarylamine - Alkyl aryl ether - Pyrimidone - Alkylarylthioether - Piperidine - Pyridine - Pyrimidine - 1,3-thiazol-2-amine - Heteroaromatic compound - Thiazole - Vinylogous amide - Azole - Tertiary amine - Amino acid - Amino acid or derivatives - Sulfenyl compound - Thioether - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Carboxylic acid - Ether - Amine - Organonitrogen compound - Organofluoride - Organohalogen compound - Organooxygen compound - Organosulfur compound - Organic oxygen compound - Organic nitrogen compound - Organic oxide - Alkyl fluoride - Alkyl halide - Hydrocarbon derivative - 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