Compound Identification
SMILES
CC1=C(Cl)C2=C(NCC3=CC4=C(OCCO4)C=C3)N=C(N=C2S1)C1=NC=CN=C1
InChIKey
InChIKey=HSYKOXQOPNFTBQ-UHFFFAOYSA-N
Formula
C20H16ClN5O2S
Mass
425.89
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
Thienopyrimidines Alkyl aryl ethers Aminopyrimidines and derivatives Pyrazines Aryl chlorides Benzenoids Imidolactams Para dioxins Heteroaromatic compounds Thiophenes Oxacyclic compounds Azacyclic compounds Hydrocarbon derivatives Amines Organochlorides Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzo-1,4-dioxane - Thienopyrimidine - Alkyl aryl ether - Aminopyrimidine - Aryl chloride - Aryl halide - Para-dioxin - Pyrazine - Pyrimidine - Benzenoid - Imidolactam - Thiophene - Heteroaromatic compound - Ether - Azacycle - Oxacycle - Organic nitrogen compound - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Hydrocarbon derivative - Amine - Organopnictogen 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