Compound Identification
SMILES
COC1=C(OC)C(OC)=C2SC(NCC3CCN(CC4COC5=CC=CC=C5O4)CC3)=NC2=C1
InChIKey
InChIKey=VEBOUDUJDAQGRS-UHFFFAOYSA-N
Formula
C25H31N3O5S
Mass
485.6
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
Benzothiazoles Anisoles Alkyl aryl ethers Piperidines Para dioxins 2-amino-1,3-thiazoles Heteroaromatic compounds Trialkylamines Oxacyclic compounds Azacyclic compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzo-1,4-dioxane - 1,3-benzothiazole - Anisole - Phenol ether - Alkyl aryl ether - Para-dioxin - Piperidine - Benzenoid - 1,3-thiazol-2-amine - Thiazole - Heteroaromatic compound - Azole - Tertiary amine - Tertiary aliphatic amine - Oxacycle - Ether - Azacycle - Amine - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - 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