Compound Identification
SMILES
CC1=CC(C=C2C(=N)N3N=C(SC3=NC2=O)C2CCCCC2)=C(C)N1C1=CC(Cl)=C(C)C=C1
InChIKey
InChIKey=OFVJHJBZPSJCKV-UHFFFAOYSA-N
Formula
C25H26ClN5OS
Mass
480.03
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
Toluenes Pyrimidones Chlorobenzenes Aryl chlorides Hydropyrimidines Imidolactams Thiadiazolines Heteroaromatic compounds N-acylimines Amidines Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Carboxylic acids and derivatives Carbonyl compounds Organopnictogen compounds Organochlorides Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-phenylpyrrole - Chlorobenzene - Halobenzene - Pyrimidone - Toluene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Hydropyrimidine - 1,4,5,6-tetrahydropyrimidine - Pyrimidine - Benzenoid - Imidolactam - Thiadiazoline - Heteroaromatic compound - N-acylimine - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Amidine - Organic oxide - Organohalogen compound - Organic oxygen compound - Hydrocarbon derivative - Organochloride - Organonitrogen compound - Organooxygen compound - Organopnictogen compound - Organic nitrogen compound - Carbonyl group - 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