Compound Identification
SMILES
CC1=CC(C(=O)COC(=O)C2=C(Cl)C3=C(S2)C=C(Cl)C=C3)=C(C)N1C1=CC(C)=C(C)C=C1
InChIKey
InChIKey=PRBLEODBXPYYKM-UHFFFAOYSA-N
Formula
C25H21Cl2NO3S
Mass
486.41
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
1-benzothiophenes o-Xylenes Thiophene carboxylic acids and derivatives Aryl alkyl ketones Aryl chlorides Vinylogous halides Vinylogous amides Heteroaromatic compounds Carboxylic acid esters Azacyclic compounds Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-phenylpyrrole - 1-benzothiophene - Benzothiophene - O-xylene - Xylene - Thiophene carboxylic acid or derivatives - Aryl ketone - Aryl alkyl ketone - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Thiophene - Vinylogous amide - Vinylogous halide - Ketone - Carboxylic acid ester - Carboxylic acid derivative - Azacycle - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Hydrocarbon derivative - Organic nitrogen 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