Compound Identification
SMILES
CN1C(CN=C1C(=O)C1=CNC2=C1C=CC(Br)=C2)C1=CNC2=C1C=CC(Br)=C2
InChIKey
InChIKey=XJNQLUABQQVMSB-UHFFFAOYSA-N
Formula
C21H16Br2N4O
Mass
500.194
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
-
Class
Indoles and derivatives
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Subclass
Indoles
- Level 5 3-alkylindoles
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Subclass
Indoles
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Class
Indoles and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Indoles and derivatives
Subclass
Indoles
Intermediate Tree Nodes
Not available
Direct Parent
3-alkylindoles
Alternative Parents
Aryl ketones Substituted pyrroles Aryl bromides Imidolactams Benzenoids Vinylogous amides Imidazolines Heteroaromatic compounds Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Carboximidamides Carboxamidines Hydrocarbon derivatives Organic oxides Organobromides Amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
3-alkylindole - Aryl ketone - Aryl bromide - Aryl halide - Substituted pyrrole - Imidolactam - Benzenoid - 2-imidazoline - Pyrrole - Heteroaromatic compound - Vinylogous amide - Ketone - Organic 1,3-dipolar compound - Carboximidamide - Azacycle - Amidine - Carboxylic acid amidine - Propargyl-type 1,3-dipolar organic compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organobromide - Organohalogen compound - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 3-alkylindoles. These are compounds containing an indole moiety that carries an alkyl chain at the 3-position.
External Descriptors
Not available