Compound Identification
SMILES
CC1=C(C)C=C(SCC(=O)NC2=C(Br)C=C3NC(=O)NC3=C2)C=C1
InChIKey
InChIKey=DWLLBCWSUVYXDR-UHFFFAOYSA-N
Formula
C17H16BrN3O2S
Mass
406.3
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
o-Xylenes Thiophenol ethers N-arylamides Alkylarylthioethers Aryl bromides Imidazoles Heteroaromatic compounds Ureas Secondary carboxylic acid amides Sulfenyl compounds Azacyclic compounds Organobromides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzimidazole - Thiophenol ether - N-arylamide - Xylene - O-xylene - Aryl thioether - Alkylarylthioether - Monocyclic benzene moiety - Aryl bromide - Benzenoid - Aryl halide - Heteroaromatic compound - Imidazole - Azole - Urea - Secondary carboxylic acid amide - Carboxamide group - Azacycle - Sulfenyl compound - Carboxylic acid derivative - Thioether - Organohalogen compound - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organobromide - Organonitrogen compound - Organooxygen compound - Organosulfur 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