Compound Identification
SMILES
COC1=C(CSC2=NC3=CC=CC=C3N=C2N2CCOC(CN)C2)C=C(Br)C=C1
InChIKey
InChIKey=JURJKRWPFNZHFJ-UHFFFAOYSA-N
Formula
C21H23BrN4O2S
Mass
475.41
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Diazanaphthalenes
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Subclass
Benzodiazines
- Level 5 Quinoxalines
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Subclass
Benzodiazines
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Class
Diazanaphthalenes
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazanaphthalenes
Subclass
Benzodiazines
Intermediate Tree Nodes
Not available
Direct Parent
Quinoxalines
Alternative Parents
Phenoxy compounds Anisoles Methoxybenzenes Dialkylarylamines Alkyl aryl ethers Alkylarylthioethers Aminopyrazines Bromobenzenes Morpholines Imidolactams Aryl bromides Heteroaromatic compounds Sulfenyl compounds Azacyclic compounds Oxacyclic compounds Dialkyl ethers Hydrocarbon derivatives Monoalkylamines Organobromides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Quinoxaline - Phenoxy compound - Aryl thioether - Anisole - Phenol ether - Methoxybenzene - Dialkylarylamine - Alkyl aryl ether - Aminopyrazine - Bromobenzene - Halobenzene - Alkylarylthioether - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Morpholine - Oxazinane - Pyrazine - Imidolactam - Benzenoid - Heteroaromatic compound - Sulfenyl compound - Thioether - Azacycle - Dialkyl ether - Ether - Oxacycle - Organic oxygen compound - Primary aliphatic amine - Hydrocarbon derivative - Organohalogen compound - Organobromide - Organonitrogen compound - Primary amine - Organic nitrogen compound - Amine - Organooxygen compound - Organosulfur compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as quinoxalines. These are compounds containing a quinoxaline moiety, a bicyclic heterocycle made up of a benzene ring fused to a pyrazine ring.
External Descriptors
Not available