Compound Identification
SMILES
CC1(C)C(Cl)C[C@]23[C@@H]4CC(=O)N2C=CC2=NC(=O)N[C@]12N3C1=C4C=CC(Br)=C1
InChIKey
InChIKey=JEVYNKSHGQMDPV-QTSSKDNASA-N
Formula
C20H18BrClN4O2
Mass
461.74
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
- Subclass Pyrroloindoles
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Class
Indoles and derivatives
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Indoles and derivatives
Subclass
Pyrroloindoles
Intermediate Tree Nodes
Not available
Direct Parent
Pyrroloindoles
Alternative Parents
Azaspirodecane derivatives Indoles Dialkylarylamines Pyrrolidine-2-ones Aryl bromides Piperidines Benzenoids Tertiary carboxylic acid amides Pyrroles Imidazolines Lactams Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Organic oxides Hydrocarbon derivatives Organobromides Carbonyl compounds Organochlorides Organopnictogen compounds Alkyl chlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyrroloindole - Azaspirodecane - Indole - Dialkylarylamine - Aryl bromide - Aryl halide - Piperidine - Benzenoid - 2-pyrrolidone - Pyrrolidone - 3-imidazoline - Pyrrole - Pyrrolidine - Tertiary carboxylic acid amide - Carboxamide group - Lactam - Azacycle - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Carboxylic acid derivative - Organooxygen compound - Organobromide - Organohalogen compound - Alkyl halide - Hydrocarbon derivative - Organic oxide - Organochloride - Alkyl chloride - Carbonyl group - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Amine - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pyrroloindoles. These are compounds containing a pyrroloindole moiety, which is a tricyclic heterocycle which consists of a pyrrole ring fused to an indole. Pyrrole is 5-membered ring consisting of four carbon atoms and one nitrogen atom. Indole is a bicyclic compound consisting of a six-membered benzene ring fused to a five-membered nitrogen-containing pyrrole ring.
External Descriptors
Not available