Compound Identification
SMILES
COCCN1CCC(CC1)NC1=CC2=C(C(=C3NC4=CC=CC=C4N3)C3=CC(OC)=CC=C3)C(=O)N=C2C=C1
InChIKey
InChIKey=COEMUQCMFDXCHN-UHFFFAOYSA-N
Formula
C31H33N5O3
Mass
523.637
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzimidazoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzimidazoles
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzimidazoles
Alternative Parents
Indoles and derivatives Phenoxy compounds Methoxybenzenes Anisoles Secondary alkylarylamines Alkyl aryl ethers Aminopiperidines Trialkylamines N-acylimines Ketene acetals Amino acids and derivatives Dialkyl ethers Azacyclic compounds Organic oxides Carbonyl compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzimidazole - Indole or derivatives - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - Alkyl aryl ether - 4-aminopiperidine - Secondary aliphatic/aromatic amine - Monocyclic benzene moiety - Benzenoid - Piperidine - Amino acid or derivatives - N-acylimine - Ketene acetal or derivatives - Tertiary aliphatic amine - Tertiary amine - Ether - Dialkyl ether - Carboxylic acid derivative - Azacycle - Secondary amine - Organic nitrogen compound - Amine - Carbonyl group - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzimidazoles. These are organic compounds containing a benzene ring fused to an imidazole ring (five member ring containing a nitrogen atom, 4 carbon atoms, and two double bonds).
External Descriptors
Not available