Compound Identification
SMILES
CC1=C(CN2N=CC3=C2C(OC(C)(C)C(O)=O)=CC=C3)SC(=N1)C1=CC=C(C=C1)C(F)(F)F
InChIKey
InChIKey=HCYWJHDBLKGIQR-UHFFFAOYSA-N
Formula
C23H20F3N3O3S
Mass
475.49
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Phenoxyacetic acid derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Phenoxyacetic acid derivatives
Alternative Parents
Trifluoromethylbenzenes Indazoles Phenol ethers 2,4,5-trisubstituted thiazoles Alkyl aryl ethers Pyrazoles Heteroaromatic compounds Azacyclic compounds Monocarboxylic acids and derivatives Carboxylic acids Hydrocarbon derivatives Carbonyl compounds Organic oxides Alkyl fluorides Organofluorides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenoxyacetate - Trifluoromethylbenzene - Indazole - Benzopyrazole - 2,4,5-trisubstituted 1,3-thiazole - Phenol ether - Alkyl aryl ether - Azole - Heteroaromatic compound - Pyrazole - Thiazole - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Azacycle - Ether - Carboxylic acid - Organoheterocyclic compound - Organic nitrogen compound - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Alkyl halide - Alkyl fluoride - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenoxyacetic acid derivatives. These are compounds containing an anisole where the methane group is linked to an acetic acid or a derivative.
External Descriptors
Not available