Compound Identification
SMILES
CC(C)(C(=O)NCCN)C1=CN2C=C(N=C(CC3=CNC4=CC=CC=C34)C2=N1)C1=CC=C(Br)C=C1
InChIKey
InChIKey=QYVDSAFOFYBPJZ-UHFFFAOYSA-N
Formula
C27H27BrN6O
Mass
531.458
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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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
Imidazopyrazines Bromobenzenes Substituted pyrroles Pyrazines N-substituted imidazoles Aryl bromides Heteroaromatic compounds Secondary carboxylic acid amides Amino acids and derivatives Azacyclic compounds Organobromides Organic oxides Monoalkylamines Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
3-alkylindole - Imidazopyrazine - Halobenzene - Bromobenzene - N-substituted imidazole - Aryl bromide - Monocyclic benzene moiety - Pyrazine - Substituted pyrrole - Aryl halide - Benzenoid - Pyrrole - Imidazole - Azole - Heteroaromatic compound - Secondary carboxylic acid amide - Carboxamide group - Amino acid or derivatives - Carboxylic acid derivative - Azacycle - Amine - Primary aliphatic amine - Organohalogen compound - Organobromide - Organonitrogen compound - Carbonyl group - Organooxygen compound - Primary amine - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - 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