Compound Identification
SMILES
CCOC(=O)C1=C(N\C=C2\C3=C(OC4=C3CCCC4)C=CC2=O)SC=C1C1=CC=C(Br)C=C1
InChIKey
InChIKey=OJHYPCRPRWUXJB-QGOAFFKASA-N
Formula
C26H22BrNO4S
Mass
524.43
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzofurans
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzofurans
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzofurans
Alternative Parents
Thiophene carboxylic acids and derivatives Bromobenzenes 2-aminothiophenes Aryl bromides Vinylogous amides Furans Heteroaromatic compounds Carboxylic acid esters Cyclic ketones Enamines Oxacyclic compounds Monocarboxylic acids and derivatives Organic oxides Aldehydes Organobromides Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzofuran - Thiophene carboxylic acid or derivatives - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - 2-aminothiophene - Benzenoid - Heteroaromatic compound - Vinylogous amide - Thiophene - Furan - Carboxylic acid ester - Cyclic ketone - Ketone - Carboxylic acid derivative - Oxacycle - Enamine - Monocarboxylic acid or derivatives - Organooxygen compound - Organic nitrogen compound - Aldehyde - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organonitrogen compound - Organobromide - Organic oxygen compound - Organohalogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzofurans. These are organic compounds containing a benzene ring fused to a furan. Furan is a five-membered aromatic ring with four carbon atoms and one oxygen atom.
External Descriptors
Not available