Compound Identification
SMILES
CSC1=NN2C(S1)=NC(=O)C(=CC1=C(C)N(C(C)=C1)C1=CC=CC(=C1)C(F)(F)F)C2=N
InChIKey
InChIKey=ZBGHLQLHUBEQSD-UHFFFAOYSA-N
Formula
C20H16F3N5OS2
Mass
463.5
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
Trifluoromethylbenzenes Pyrimidones Hydropyrimidines Imidolactams Thiadiazolines Heteroaromatic compounds N-acylimines Amidines Azacyclic compounds Carboxylic acids and derivatives Sulfenyl compounds Propargyl-type 1,3-dipolar organic compounds Carbonyl compounds Hydrocarbon derivatives Alkyl fluorides Organofluorides Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-phenylpyrrole - Trifluoromethylbenzene - Pyrimidone - Monocyclic benzene moiety - Hydropyrimidine - 1,4,5,6-tetrahydropyrimidine - Pyrimidine - Benzenoid - Imidolactam - Heteroaromatic compound - Thiadiazoline - N-acylimine - Propargyl-type 1,3-dipolar organic compound - Sulfenyl compound - Azacycle - Organic 1,3-dipolar compound - Carboxylic acid derivative - Amidine - Organic oxide - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Organosulfur compound - Alkyl halide - Organic nitrogen compound - Carbonyl group - Organic oxygen compound - Alkyl fluoride - Hydrocarbon derivative - 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