Compound Identification
SMILES
CC1=CC(C=NNC(=O)C2=CC3=C(O2)C=CC(Cl)=C3)=C(C)N1C1=C(C(O)=O)C2=C(CCCC2)S1
InChIKey
InChIKey=JXHHWKGKYZGBLQ-UHFFFAOYSA-N
Formula
C25H22ClN3O4S
Mass
495.98
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 Furoic acid and derivatives Substituted pyrroles Aryl chlorides Benzenoids Vinylogous amides Heteroaromatic compounds Oxacyclic compounds Azacyclic compounds Carboxylic acids Monocarboxylic acids and derivatives Hydrocarbon derivatives Organic oxides Organochlorides Organonitrogen compounds Organooxygen compounds Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzofuran - Furoic acid or derivatives - Thiophene carboxylic acid - Thiophene carboxylic acid or derivatives - Aryl chloride - Aryl halide - Substituted pyrrole - Benzenoid - Furan - Pyrrole - Heteroaromatic compound - Thiophene - Vinylogous amide - Monocarboxylic acid or derivatives - Carboxylic acid - Oxacycle - Carboxylic acid derivative - Azacycle - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organic oxygen compound - Organopnictogen 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