Compound Identification
SMILES
CC1=CC(C(=O)CSC2=NC3=CC=CC=C3N2CCC2=CC=CC=C2)=C(C)N1CC1=CC=CO1
InChIKey
InChIKey=YECQRYIKBHSZBT-UHFFFAOYSA-N
Formula
C28H27N3O2S
Mass
469.6
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
Aryl alkyl ketones Alkylarylthioethers Benzene and substituted derivatives N-substituted imidazoles Substituted pyrroles Vinylogous amides Heteroaromatic compounds Furans Azacyclic compounds Oxacyclic compounds Sulfenyl compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Aldehydes Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzimidazole - Aryl thioether - Aryl alkyl ketone - Aryl ketone - Alkylarylthioether - Monocyclic benzene moiety - N-substituted imidazole - Benzenoid - Substituted pyrrole - Azole - Furan - Imidazole - Heteroaromatic compound - Vinylogous amide - Pyrrole - Ketone - Oxacycle - Azacycle - Sulfenyl compound - Thioether - Organonitrogen compound - Aldehyde - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - 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