Compound Identification
SMILES
COC(=O)COC1=CC=C(SC2=CC=C(NC3=NCCN3)C=C2)C=C1
InChIKey
InChIKey=XLJJLHACQJLTEP-UHFFFAOYSA-N
Formula
C18H19N3O3S
Mass
357.43
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
Diarylthioethers Thiophenol ethers Phenoxy compounds Phenol ethers Imidazolyl carboxylic acids and derivatives Aniline and substituted anilines Alkyl aryl ethers Methyl esters Imidazolines Guanidines Sulfenyl compounds Propargyl-type 1,3-dipolar organic compounds Monocarboxylic acids and derivatives Carboximidamides Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Amines Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Diarylthioether - Phenoxyacetate - Phenoxy compound - Aryl thioether - Imidazolyl carboxylic acid derivative - Aniline or substituted anilines - Phenol ether - Thiophenol ether - Alkyl aryl ether - 2-imidazoline - Methyl ester - Carboxylic acid ester - Guanidine - Carboxylic acid derivative - Ether - Azacycle - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Organic 1,3-dipolar compound - Thioether - Propargyl-type 1,3-dipolar organic compound - Carboximidamide - Sulfenyl compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - Organic oxygen compound - Amine - Organic oxide - Hydrocarbon derivative - Aromatic heteromonocyclic 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