Compound Identification
SMILES
CCOC(=O)COC1=CC2=C(OC(C)(C=C2NNC(=S)NC2=C(C)C=C(C)C=C2)C2=CN=CC=C2)C=C1
InChIKey
InChIKey=KKDNDZRUECAETK-UHFFFAOYSA-N
Formula
C28H30N4O4S
Mass
518.63
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
1-benzopyrans m-Xylenes Alkyl aryl ethers Pyridines and derivatives Thiosemicarbazides Heteroaromatic compounds Carboxylic acid esters Oxacyclic compounds Monocarboxylic acids and derivatives Azacyclic compounds Organosulfur compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenoxyacetate - Benzopyran - 1-benzopyran - M-xylene - Xylene - Alkyl aryl ether - Pyridine - Heteroaromatic compound - Thiosemicarbazide - Carboxylic acid ester - Carboxylic acid derivative - Ether - Monocarboxylic acid or derivatives - Oxacycle - Azacycle - Organoheterocyclic compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organosulfur compound - Organic oxide - Hydrocarbon derivative - Carbonyl group - Organic nitrogen compound - Organopnictogen 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