Compound Identification
SMILES
COC1=CC(OC(CCN2CCC(CC2)N2C(=O)N(CCN(C)CC3=CC=CC=C3)C3=CC=CC=C23)C(C)C)=C(C)C=C1
InChIKey
InChIKey=XVXQCAYRXMTFHP-UHFFFAOYSA-N
Formula
C36H48N4O3
Mass
584.805
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
Anisoles Phenylmethylamines Phenoxy compounds Benzylamines Methoxybenzenes Alkyl aryl ethers Toluenes Aralkylamines Piperidines N-substituted imidazoles Heteroaromatic compounds Ureas Trialkylamines Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzimidazole - Anisole - Benzylamine - Phenol ether - Phenylmethylamine - Methoxybenzene - Phenoxy compound - Aralkylamine - Toluene - Alkyl aryl ether - Benzenoid - Piperidine - Monocyclic benzene moiety - N-substituted imidazole - Azole - Heteroaromatic compound - Imidazole - Urea - Tertiary aliphatic amine - Tertiary amine - Azacycle - Ether - Amine - Organic nitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organonitrogen compound - 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