Compound Identification
SMILES
OC(CCCN1CCC2=C(C1)C1=C(C=CC(F)=C1)N2C1=CC=C(F)C=C1)C1=CC=CS1
InChIKey
InChIKey=RQOMKYBFUBMKFV-UHFFFAOYSA-N
Formula
C25H24F2N2OS
Mass
438.54
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
3-alkylindoles Fluorobenzenes Aralkylamines Aryl fluorides Thiophenes Heteroaromatic compounds Trialkylamines Secondary alcohols Azacyclic compounds Organofluorides Hydrocarbon derivatives Aromatic alcohols
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-phenylpyrrole - 3-alkylindole - Indole - Indole or derivatives - Fluorobenzene - Halobenzene - Aralkylamine - Benzenoid - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Heteroaromatic compound - Thiophene - Tertiary aliphatic amine - Tertiary amine - Secondary alcohol - Azacycle - Organofluoride - Organohalogen compound - Organic oxygen compound - Organic nitrogen compound - Amine - Alcohol - Aromatic alcohol - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - 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