Compound Identification
SMILES
CC1=CC=C(C=C1)C1=C(N=C(SCC(=O)C(C#N)=C2NC3=CC=CC=C3N2)N=N1)C1=CC=C(C)C=C1
InChIKey
InChIKey=AQJGJOFTMBUCFF-UHFFFAOYSA-N
Formula
C28H22N6OS
Mass
490.59
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
Toluenes Alkylarylthioethers 1,2,4-triazines Vinylogous amides Heteroaromatic compounds Enones Acryloyl compounds Ketones Ketene acetals Sulfenyl compounds Nitriles Azacyclic compounds Organic oxides Hydrocarbon derivatives Amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzimidazole - Aryl thioether - Toluene - Alkylarylthioether - Monocyclic benzene moiety - Triazine - 1,2,4-triazine - Benzenoid - Acryloyl-group - Enone - Heteroaromatic compound - Vinylogous amide - Ketene acetal or derivatives - Ketone - Thioether - Nitrile - Carbonitrile - Azacycle - Sulfenyl compound - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Amine - Organic nitrogen compound - Organic oxide - Carbonyl group - Cyanide - Organic oxygen 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