Compound Identification
SMILES
CC1=CC(\C=C2/C(=O)N=C3SC(=NN3C2=N)C2=CN=CC=C2)=C(C)N1C1=C(C)C=C(C)C=C1
InChIKey
InChIKey=CHVQDYFSSQRVQP-JYHUHERQSA-N
Formula
C25H22N6OS
Mass
454.55
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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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
m-Xylenes Pyrimidones Pyridines and derivatives Imidolactams Hydropyrimidines Thiadiazolines Heteroaromatic compounds N-acylimines Propargyl-type 1,3-dipolar organic compounds Carboxylic acids and derivatives Azacyclic compounds Amidines Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-phenylpyrrole - M-xylene - Xylene - Pyrimidone - Monocyclic benzene moiety - Hydropyrimidine - 1,4,5,6-tetrahydropyrimidine - Pyridine - Pyrimidine - Imidolactam - Benzenoid - Heteroaromatic compound - Thiadiazoline - N-acylimine - Organic 1,3-dipolar compound - Azacycle - Amidine - Carboxylic acid derivative - Propargyl-type 1,3-dipolar organic compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic oxygen compound - Carbonyl group - 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