Compound Identification
SMILES
CCCCC1=NC=C(CO)N1CC1=CC=C(C=C1)N1C(=CC=C1C(F)(F)F)C1=NNN=N1
InChIKey
InChIKey=GQNSRULQLLCAKY-UHFFFAOYSA-N
Formula
C21H22F3N7O
Mass
445.45
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pyrroles
-
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
1,2,5-trisubstituted imidazoles N-substituted imidazoles Benzene and substituted derivatives Tetrazoles Heteroaromatic compounds Azacyclic compounds Primary alcohols Organonitrogen compounds Organofluorides Hydrocarbon derivatives Aromatic alcohols Alkyl fluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
1-phenylpyrrole - 1,2,5-trisubstituted-imidazole - Trisubstituted imidazole - Monocyclic benzene moiety - N-substituted imidazole - Benzenoid - Heteroaromatic compound - Tetrazole - Azole - Imidazole - Azacycle - Aromatic alcohol - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Alcohol - Organic oxygen compound - Organic nitrogen compound - Primary alcohol - Alkyl halide - Alkyl fluoride - Hydrocarbon derivative - 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