Compound Identification
SMILES
CC1=CC(C=NNC(=O)C2=C(Cl)N=CC=C2)=C(C)N1C1=C(C)C=CC(Cl)=C1
InChIKey
InChIKey=TUVZRLGCLBBIAG-UHFFFAOYSA-N
Formula
C20H18Cl2N4O
Mass
401.29
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pyrroles
-
Subclass
Substituted pyrroles
- Level 5 Phenylpyrroles
-
Subclass
Substituted pyrroles
-
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
Nicotinamides Toluenes Chlorobenzenes 2-halopyridines Aryl chlorides Vinylogous halides Heteroaromatic compounds Carboxylic acids and derivatives Azacyclic compounds Organooxygen compounds Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
1-phenylpyrrole - Nicotinamide - Pyridine carboxylic acid or derivatives - Chlorobenzene - Halobenzene - 2-halopyridine - Toluene - Benzenoid - Monocyclic benzene moiety - Pyridine - Aryl halide - Aryl chloride - Vinylogous halide - Heteroaromatic compound - Azacycle - Carboxylic acid derivative - Organohalogen compound - Organic nitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organochloride - Organonitrogen 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