Compound Identification
SMILES
CC1=NC(NC(=O)C2=CC=C(NC(=O)C3CCCO3)C=C2)=NC(=N1)C1=CC=CC=N1
InChIKey
InChIKey=CIGIVCYBHKGPJH-UHFFFAOYSA-N
Formula
C21H20N6O3
Mass
404.43
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Acylaminobenzoic acid and derivatives
Alternative Parents
Anilides Benzamides N-arylamides Benzoyl derivatives Aminotriazines 1,3,5-triazines Pyridines and derivatives Oxolanes Heteroaromatic compounds Secondary carboxylic acid amides Azacyclic compounds Oxacyclic compounds Dialkyl ethers Carbonyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Acylaminobenzoic acid or derivatives - Benzamide - Anilide - Benzoyl - N-arylamide - Amino-1,3,5-triazine - Pyridine - 1,3,5-triazine - Triazine - Heteroaromatic compound - Oxolane - Carboxamide group - Secondary carboxylic acid amide - Carboxylic acid derivative - Dialkyl ether - Ether - Oxacycle - Azacycle - Organoheterocyclic compound - Organic nitrogen compound - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organic oxide - Carbonyl group - Hydrocarbon derivative - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as acylaminobenzoic acid and derivatives. These are derivatives of amino benzoic acid derivatives where the amine group is N-acylated.
External Descriptors
Not available