Compound Identification
SMILES
OC(=O)\C=C/C(O)=O.O=C(CCN1C(CN2CCN(C\C=C\C3=CC=CC=C3)CC2)=NC2=CC=CC=C12)C1=CC=CS1
InChIKey
InChIKey=ODZDVOAQCXEFNT-OCAIAXJTSA-N
Formula
C32H34N4O5S
Mass
586.71
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
Styrenes Aryl alkyl ketones N-alkylpiperazines Aralkylamines Unsaturated fatty acids N-substituted imidazoles Dicarboxylic acids and derivatives Thiophenes Heteroaromatic compounds Trialkylamines Carboxylic acids Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Not available
Substituents
Benzimidazole - Styrene - Aryl ketone - Aryl alkyl ketone - N-alkylpiperazine - Aralkylamine - Monocyclic benzene moiety - 1,4-diazinane - Dicarboxylic acid or derivatives - N-substituted imidazole - Piperazine - Unsaturated fatty acid - Benzenoid - Fatty acid - Fatty acyl - Thiophene - Heteroaromatic compound - Imidazole - Azole - Tertiary amine - Tertiary aliphatic amine - Ketone - Carboxylic acid - Azacycle - Carboxylic acid derivative - Organic oxygen compound - Amine - Carbonyl group - Organic oxide - Organonitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organic nitrogen 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