Compound Identification
SMILES
CC1=NC(SCC2COC3=CC=CC=C3O2)=C(C#N)C(C)=C1
InChIKey
InChIKey=OZODCRVNXSUEMZ-UHFFFAOYSA-N
Formula
C17H16N2O2S
Mass
312.39
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Benzodioxanes
- Subclass Benzo-1,4-dioxanes
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Class
Benzodioxanes
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzodioxanes
Subclass
Benzo-1,4-dioxanes
Intermediate Tree Nodes
Not available
Direct Parent
Benzo-1,4-dioxanes
Alternative Parents
3-pyridinecarbonitriles Methylpyridines Alkylarylthioethers Alkyl aryl ethers Para dioxins Benzenoids Heteroaromatic compounds Sulfenyl compounds Oxacyclic compounds Nitriles Azacyclic compounds Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzo-1,4-dioxane - Aryl thioether - 3-pyridinecarbonitrile - Alkyl aryl ether - Methylpyridine - Alkylarylthioether - Para-dioxin - Pyridine - Benzenoid - Heteroaromatic compound - Azacycle - Oxacycle - Nitrile - Sulfenyl compound - Thioether - Carbonitrile - Ether - Organic nitrogen compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Cyanide - Organopnictogen compound - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzo-1,4-dioxanes. These are heterocyclic compounds containing a benzene ring fused to a 1,4-dioxane ring.
External Descriptors
Not available