Compound Identification
SMILES
CC1=CC(C(=O)COC(=O)CC2SC3=CC=CC=C3NC2=O)=C(C)N1C1=CC=CC(=C1)C(F)(F)F
InChIKey
InChIKey=FOMVHRKJWBCGNC-UHFFFAOYSA-N
Formula
C25H21F3N2O4S
Mass
502.51
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
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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
Trifluoromethylbenzenes Benzothiazines Aryl alkyl ketones Alkylarylthioethers Alpha-acyloxy ketones 1,4-thiazines Vinylogous amides Heteroaromatic compounds Secondary carboxylic acid amides Lactams Carboxylic acid esters Monocarboxylic acids and derivatives Azacyclic compounds Hydrocarbon derivatives Organic oxides Organofluorides Alkyl fluorides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-phenylpyrrole - Trifluoromethylbenzene - Benzothiazine - Aryl thioether - Aryl ketone - Aryl alkyl ketone - Alkylarylthioether - Alpha-acyloxy ketone - Para-thiazine - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Vinylogous amide - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Ketone - Lactam - Azacycle - Thioether - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Alkyl fluoride - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organic oxygen compound - Alkyl halide - Organic nitrogen 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