Compound Identification
SMILES
COC(=O)C1=CC=C(C=C1)N1C(C)=CC(C=C(C#N)C(=O)NC2=CC=C(SC(F)F)C=C2)=C1C
InChIKey
InChIKey=JSAWWLWJQOPUBT-UHFFFAOYSA-N
Formula
C25H21F2N3O3S
Mass
481.52
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
Benzoic acid esters Anilides Thiophenol ethers N-arylamides Benzoyl derivatives Alkylarylthioethers Methyl esters Heteroaromatic compounds Secondary carboxylic acid amides Sulfenyl compounds Nitriles Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organofluorides Alkyl fluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
1-phenylpyrrole - Benzoate ester - Benzoic acid or derivatives - Anilide - Benzoyl - Aryl thioether - Thiophenol ether - N-arylamide - Alkylarylthioether - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Methyl ester - Carboxamide group - Carboxylic acid ester - Secondary carboxylic acid amide - Sulfenyl compound - Azacycle - Thioether - Carboxylic acid derivative - Carbonitrile - Nitrile - Alkyl halide - Organohalogen compound - Organofluoride - Organonitrogen compound - Cyanide - Organooxygen compound - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Organic nitrogen compound - Alkyl fluoride - Organic oxide - Organosulfur 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