Compound Identification
SMILES
CN1C(=O)N(C)C(=O)C(C(=O)COC(=O)C2=C(C)N(C(C)=C2)C2=CC=CC=C2)=C1N
InChIKey
InChIKey=YSNIWNDBSPWLQA-UHFFFAOYSA-N
Formula
C21H22N4O5
Mass
410.43
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pyrroles
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Subclass
Substituted pyrroles
- Level 5 Phenylpyrroles
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Subclass
Substituted pyrroles
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Class
Pyrroles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrroles
Subclass
Substituted pyrroles
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyrroles
Alternative Parents
Pyrrole carboxylic acids and derivatives Aryl alkyl ketones Aminopyrimidines and derivatives Pyrimidones Benzene and substituted derivatives Hydropyrimidines Vinylogous amides Heteroaromatic compounds Amino acids and derivatives Ureas Carboxylic acid esters Lactams Monocarboxylic acids and derivatives Azacyclic compounds Primary amines Organopnictogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
1-phenylpyrrole - Pyrrole-3-carboxylic acid or derivatives - Aryl ketone - Aryl alkyl ketone - Aminopyrimidine - Pyrimidone - Monocyclic benzene moiety - Hydropyrimidine - Pyrimidine - Benzenoid - Vinylogous amide - Heteroaromatic compound - Urea - Carboxylic acid ester - Amino acid or derivatives - Ketone - Lactam - Azacycle - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organic oxygen compound - Primary amine - Organic nitrogen compound - Organopnictogen compound - Amine - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organooxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpyrroles. These are polycyclic aromatic compounds containing a benzene ring linked to a pyrrole ring through a CC or CN bond.
External Descriptors
Not available