Compound Identification
SMILES
CCOC(=O)C1=CC(NC(=O)N2CCCN2C(=O)CCSCNC(C)=O)=CC=C1
InChIKey
InChIKey=XFPGXMAKIPFUMI-UHFFFAOYSA-N
Formula
C19H26N4O5S
Mass
422.5
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Benzoic acids and derivatives
- Level 5 Benzoic acid esters
-
Subclass
Benzoic acids and derivatives
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Benzoic acid esters
Alternative Parents
N-phenylureas Benzoyl derivatives Semicarbazides Pyrazolidines N,S-acetals Acetamides Secondary carboxylic acid amides Carboxylic acid hydrazides Carboxylic acid esters Sulfenyl compounds Dialkylthioethers Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Benzoate ester - N-phenylurea - Benzoyl - Pyrazolidine - Semicarbazide - N,s-acetal - Acetamide - Carboxamide group - Carboxylic acid ester - Carboxylic acid hydrazide - Secondary carboxylic acid amide - Thioether - Azacycle - Carboxylic acid derivative - Hemithioaminal - Sulfenyl compound - Dialkylthioether - Organoheterocyclic compound - Carbonyl group - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as benzoic acid esters. These are ester derivatives of benzoic acid.
External Descriptors
Not available