Compound Identification
SMILES
COC1=CC(=CC2=C1OCO2)[C@@H](O)[C@@H](O)CN1C(=S)NC2=CC=CC=C12
InChIKey
InChIKey=UXWCNZRMSHDRIQ-XJKSGUPXSA-N
Formula
C18H18N2O5S
Mass
374.41
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
Benzimidazoles Anisoles Alkyl aryl ethers N-substituted imidazoles Imidazolethiones Heteroaromatic compounds Thioureas Secondary alcohols 1,2-diols Oxacyclic compounds Acetals Azacyclic compounds Aromatic alcohols Hydrocarbon derivatives Organonitrogen compounds Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzimidazole - Benzodioxole - Anisole - Alkyl aryl ether - Imidazole-2-thione - N-substituted imidazole - Benzenoid - Azole - Imidazole - Heteroaromatic compound - Secondary alcohol - Thiourea - 1,2-diol - Azacycle - Oxacycle - Ether - Acetal - Organosulfur compound - Alcohol - Hydrocarbon derivative - Organopnictogen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Aromatic alcohol - 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