Compound Identification
SMILES
Cl.NC1=CC=CC(CN2C(=CC=C2C2=CC=CC=C2Cl)C2=CC=C(OC3=NC=CS3)C=C2)=N1
InChIKey
InChIKey=PGTXXAQPQYBRJU-UHFFFAOYSA-N
Formula
C25H20Cl2N4OS
Mass
495.42
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pyrroles
-
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
Diarylethers Phenoxy compounds Phenol ethers Chlorobenzenes Aminopyridines and derivatives Imidolactams Aryl chlorides Thiazoles Heteroaromatic compounds Azacyclic compounds Primary amines Organochlorides Hydrochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Diaryl ether - 2-phenylpyrrole - Phenoxy compound - Phenol ether - Aminopyridine - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Pyridine - Benzenoid - Imidolactam - Heteroaromatic compound - Thiazole - Azole - Azacycle - Ether - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Hydrocarbon derivative - Organic oxygen compound - Hydrochloride - Primary amine - Amine - Organic nitrogen 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