Compound Identification
SMILES
CC1=CC=C(O1)C1C(C#N)=C(NC2=C1C(=O)CC(C)(C)C2)SCC(=O)NC1=CC2=C(OCO2)C=C1
InChIKey
InChIKey=WHGOHAQMJUGFCO-UHFFFAOYSA-N
Formula
C26H25N3O5S
Mass
491.56
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzodioxoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzodioxoles
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzodioxoles
Alternative Parents
N-arylamides Cyclohexenones Dihydropyridines Benzenoids Vinylogous amides Furans Heteroaromatic compounds Secondary carboxylic acid amides Ketene acetals Oxacyclic compounds Acetals Sulfenyl compounds Azacyclic compounds Nitriles Hydrocarbon derivatives Organic oxides Organopnictogen compounds Aldehydes
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzodioxole - N-arylamide - Dihydropyridine - Cyclohexenone - Benzenoid - Furan - Heteroaromatic compound - Vinylogous amide - Carboxamide group - Ketene acetal or derivatives - Ketone - Secondary carboxylic acid amide - Acetal - Carboxylic acid derivative - Carbonitrile - Nitrile - Oxacycle - Sulfenyl compound - Azacycle - Hydrocarbon derivative - Organic oxide - Cyanide - Organopnictogen compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Carbonyl group - Organic oxygen compound - Aldehyde - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzodioxoles. These are organic compounds containing a benzene ring fused to either isomers of dioxole. Dioxole is a five-membered unsaturated ring of two oxygen atoms and three carbon atoms.
External Descriptors
Not available