Compound Identification
SMILES
COC(=O)C1=CC(Br)=C(COC2=C(C#N)C(=CC(=N2)C2=CC=C(C=C2)N2CCOCC2)C2=COC(C)=N2)S1
InChIKey
InChIKey=AZPRKTWZOBSFQZ-UHFFFAOYSA-N
Formula
C27H23BrN4O5S
Mass
595.47
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Oxazinanes
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Subclass
Morpholines
- Level 5 Phenylmorpholines
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Subclass
Morpholines
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Class
Oxazinanes
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Oxazinanes
Subclass
Morpholines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylmorpholines
Alternative Parents
Phenylpyridines Thiophene carboxylic acids and derivatives 2,3,5-trisubstituted thiophenes 3-pyridinecarbonitriles Aniline and substituted anilines Dialkylarylamines 2,4-disubstituted oxazoles Alkyl aryl ethers Aryl bromides Methyl esters Heteroaromatic compounds Amino acids and derivatives Dialkyl ethers Oxacyclic compounds Nitriles Azacyclic compounds Hydrocarbon derivatives Organic oxides Organobromides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenylmorpholine - 2-phenylpyridine - Thiophene carboxylic acid or derivatives - 2,3,5-trisubstituted thiophene - Dialkylarylamine - Aniline or substituted anilines - 3-pyridinecarbonitrile - 2,4-disubstituted 1,3-oxazole - Alkyl aryl ether - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Pyridine - Benzenoid - Thiophene - Heteroaromatic compound - Methyl ester - Azole - Oxazole - Amino acid or derivatives - Tertiary amine - Carboxylic acid ester - Azacycle - Oxacycle - Carboxylic acid derivative - Dialkyl ether - Ether - Carbonitrile - Nitrile - Organooxygen compound - Amine - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Cyanide - Organic oxide - Organohalogen compound - Organobromide - Organonitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylmorpholines. These are aromatic compounds containing a morpholine ring and a benzene ring linked to each other through a CC or a CN bond.
External Descriptors
Not available