Compound Identification
SMILES
CCOC1=C(OC)C=C(C[NH+](C)CC(=O)C(\C#N)=C2/NC3=CC=CC=C3N2C)C=C1
InChIKey
InChIKey=NRDQDXDNKJDZAO-HAVVHWLPSA-O
Formula
C23H27N4O3
Mass
407.493
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
Phenylmethylamines Phenoxy compounds Anisoles Methoxybenzenes Benzylamines Alkyl aryl ethers Aralkylamines Vinylogous amides Acryloyl compounds Quaternary ammonium salts Alpha-amino ketones Enones Trialkylamines Ketene acetals Nitriles Azacyclic compounds Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzimidazole - Phenoxy compound - Anisole - Benzylamine - Phenol ether - Methoxybenzene - Phenylmethylamine - Alkyl aryl ether - Aralkylamine - Monocyclic benzene moiety - Benzenoid - Acryloyl-group - Alpha-aminoketone - Enone - Vinylogous amide - Quaternary ammonium salt - Tertiary aliphatic amine - Tertiary amine - Ketone - Ketene acetal or derivatives - Azacycle - Nitrile - Carbonitrile - Ether - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Cyanide - Amine - Organic oxygen compound - Organic cation - 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