Compound Identification
SMILES
NC[C@H]1O[C@H]([C@@H](O)[C@H]1O)N1C=C(C2=C1N=CN=C2NC1=CC(F)=CC(F)=C1)C1=CC=CC=C1
InChIKey
InChIKey=HWBSEWGXSQDOOT-XDTJVVMOSA-N
Formula
C23H21F2N5O3
Mass
453.45
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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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
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrroles
Subclass
Substituted pyrroles
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyrroles
Alternative Parents
Glycosylamines Pentoses Pyrrolo[2,3-d]pyrimidines Aniline and substituted anilines Aminopyrimidines and derivatives Fluorobenzenes Aryl fluorides Imidolactams Oxolanes Heteroaromatic compounds 1,2-diols Secondary alcohols Secondary amines Oxacyclic compounds Azacyclic compounds Organofluorides Hydrocarbon derivatives Monoalkylamines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Glycosyl compound - N-glycosyl compound - 3-phenylpyrrole - Pentose monosaccharide - Pyrrolo[2,3-d]pyrimidine - Pyrrolopyrimidine - Aniline or substituted anilines - Aminopyrimidine - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Monosaccharide - Imidolactam - Pyrimidine - Benzenoid - Oxolane - Heteroaromatic compound - Secondary alcohol - 1,2-diol - Secondary amine - Azacycle - Oxacycle - Organooxygen compound - Primary aliphatic amine - Organic nitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Amine - Organohalogen compound - Primary amine - Organofluoride - Alcohol - Organonitrogen compound - Aromatic heteropolycyclic 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