Compound Identification
SMILES
CCOC1=CC=C(C[NH+](C)[C@@H](C)C(=O)C(C#N)=C2NC3=CC=CC=C3N2)C=C1
InChIKey
InChIKey=NWFWUXOEQXBPRB-HNNXBMFYSA-O
Formula
C22H25N4O2
Mass
377.467
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 Phenol ethers Benzylamines Alkyl aryl ethers Aralkylamines Vinylogous amides Quaternary ammonium salts Acryloyl compounds Alpha-amino ketones Enones Trialkylamines Ketene acetals Nitriles Azacyclic compounds Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzimidazole - Phenol ether - Phenylmethylamine - Benzylamine - Phenoxy compound - Alkyl aryl ether - Aralkylamine - Monocyclic benzene moiety - Benzenoid - Acryloyl-group - Alpha-aminoketone - Enone - Quaternary ammonium salt - Vinylogous amide - Ketone - Ketene acetal or derivatives - Tertiary amine - Tertiary aliphatic amine - Nitrile - Azacycle - Carbonitrile - Ether - Organic nitrogen compound - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Amine - Cyanide - 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