Compound Identification
SMILES
CC(=O)C1=CC2=C(OCO2)C=C1NC(=O)CSC1=NN=C(N1C[C@H]1CCCO1)C1=CC=CS1
InChIKey
InChIKey=VJDRJCKLFCQVSI-CQSZACIVSA-N
Formula
C22H22N4O5S2
Mass
486.56
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
Acetophenones Aryl alkyl ketones N-arylamides Alkylarylthioethers Oxolanes Vinylogous amides Heteroaromatic compounds Thiophenes Triazoles Secondary carboxylic acid amides Sulfenyl compounds Oxacyclic compounds Dialkyl ethers Azacyclic compounds Acetals Organopnictogen compounds Organic oxides Hydrocarbon derivatives Aldehydes
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Acetophenone - Benzodioxole - Aryl thioether - N-arylamide - Aryl alkyl ketone - Aryl ketone - Alkylarylthioether - Benzenoid - Azole - 1,2,4-triazole - Thiophene - Heteroaromatic compound - Oxolane - Vinylogous amide - Secondary carboxylic acid amide - Ketone - Carboxamide group - Acetal - Carboxylic acid derivative - Dialkyl ether - Ether - Oxacycle - Azacycle - Thioether - Sulfenyl compound - Aldehyde - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic oxygen compound - Organopnictogen compound - Carbonyl group - Organic oxide - 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