Compound Identification
SMILES
CC1=C(N=CC=C1)C(=O)N1CCC(CC1)N1CCN(CC2=NN=C(C=C2)S(=O)(=O)C2=CC3=C(OCO3)C=C2)CC1
InChIKey
InChIKey=WTUJUCYGIBNOLR-UHFFFAOYSA-N
Formula
C28H32N6O5S
Mass
564.66
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzodioxoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzodioxoles
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzodioxoles
Alternative Parents
Pyridinecarboxylic acids and derivatives N-acylpiperidines 2-heteroaryl carboxamides Aminopiperidines Aralkylamines Methylpyridines N-alkylpiperazines Benzenoids Pyridazines and derivatives Heteroaromatic compounds Sulfones Tertiary carboxylic acid amides Trialkylamines Amino acids and derivatives Oxacyclic compounds Acetals Azacyclic compounds Hydrocarbon derivatives Organopnictogen compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzodioxole - N-acyl-piperidine - Pyridine carboxylic acid or derivatives - 2-heteroaryl carboxamide - 4-aminopiperidine - Methylpyridine - Aralkylamine - N-alkylpiperazine - 1,4-diazinane - Piperazine - Piperidine - Pyridazine - Benzenoid - Pyridine - Heteroaromatic compound - Sulfone - Sulfonyl - Tertiary carboxylic acid amide - Tertiary aliphatic amine - Tertiary amine - Amino acid or derivatives - Carboxamide group - Azacycle - Oxacycle - Acetal - Carboxylic acid derivative - Organic nitrogen compound - Organic oxide - Organopnictogen compound - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Amine - Organosulfur compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzodioxoles. These are organic compounds containing a benzene ring fused to either isomers of dioxole. Dioxole is a five-membered unsaturated ring of two oxygen atoms and three carbon atoms.
External Descriptors
Not available