Compound Identification
SMILES
COC1=C(C\C=C\C(=O)N(C)C)C=C2C(NC3=CC(Br)=CC=C3)=C(C=NC2=C1)C#N
InChIKey
InChIKey=PDFWGIWSAHAMIQ-RUDMXATFSA-N
Formula
C23H21BrN4O2
Mass
465.351
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Quinolines and derivatives
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Subclass
Aminoquinolines and derivatives
- Level 5 4-aminoquinolines
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Subclass
Aminoquinolines and derivatives
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Class
Quinolines and derivatives
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Quinolines and derivatives
Subclass
Aminoquinolines and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
4-aminoquinolines
Alternative Parents
Aniline and substituted anilines Anisoles Alkyl aryl ethers Aminopyridines and derivatives Bromobenzenes Primary aromatic amines Aryl bromides N-acyl amines Tertiary carboxylic acid amides Heteroaromatic compounds Amino acids and derivatives Azacyclic compounds Nitriles Secondary amines Hydrocarbon derivatives Organic oxides Organobromides Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
4-aminoquinoline - Anisole - Phenol ether - Aniline or substituted anilines - Alkyl aryl ether - Aminopyridine - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - N-acyl-amine - Primary aromatic amine - Pyridine - Benzenoid - Tertiary carboxylic acid amide - Heteroaromatic compound - Amino acid or derivatives - Carboxamide group - Azacycle - Secondary amine - Carboxylic acid derivative - Ether - Carbonitrile - Nitrile - Organohalogen compound - Carbonyl group - Organic oxide - Organobromide - Amine - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Cyanide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 4-aminoquinolines. These are organic compounds containing an amino group attached to the 4-position of a quinoline ring system.
External Descriptors
Not available