Compound Identification
SMILES
CC1=CC=C(C=C1)S(=O)(=O)N1C=C(C2=CC(Br)=CN=C12)C1=CC(F)=C(OC2CCOCC2)C=C1
InChIKey
InChIKey=CTQJWSGVUZNDCT-UHFFFAOYSA-N
Formula
C25H22BrFN2O4S
Mass
545.42
Taxonomic Classification
Taxonomy Tree
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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
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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
Tosyl compounds Benzenesulfonamides Pyrrolopyridines Benzenesulfonyl compounds Phenoxy compounds Phenol ethers Alkyl aryl ethers Fluorobenzenes Aryl bromides Aryl fluorides Pyridines and derivatives Oxanes Heteroaromatic compounds Sulfonyls Organosulfonic acids and derivatives Oxacyclic compounds Dialkyl ethers Azacyclic compounds Organic oxides Hydrocarbon derivatives Organobromides Organofluorides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
3-phenylpyrrole - Benzenesulfonamide - Tosyl compound - Benzenesulfonyl group - Pyrrolopyridine - Phenoxy compound - Phenol ether - Alkyl aryl ether - Fluorobenzene - Halobenzene - Toluene - Aryl fluoride - Pyridine - Benzenoid - Oxane - Aryl halide - Monocyclic benzene moiety - Aryl bromide - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Heteroaromatic compound - Oxacycle - Azacycle - Dialkyl ether - Ether - Hydrocarbon derivative - Organohalogen compound - Organobromide - Organofluoride - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic oxygen compound - Organic oxide - 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