Compound Identification
SMILES
CCOC(=O)C1=CN(CC2=C(F)C=CC=C2F)C2=C(C#N)C(=C(CN(C)CCC3=CC=CC=N3)N2C1=O)C1=CC=C(OCC(C)C)C=C1
InChIKey
InChIKey=JQUJZHYUBDGGCA-UHFFFAOYSA-N
Formula
C37H37F2N5O4
Mass
653.731
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
Pyrrolopyrimidines Pyrimidinecarboxylic acids Phenoxy compounds Phenol ethers Alkyl aryl ethers Pyrimidones Aralkylamines Fluorobenzenes Pyridines and derivatives Aryl fluorides Vinylogous amides Heteroaromatic compounds Trialkylamines Amino acids and derivatives Carboxylic acid esters Lactams Azacyclic compounds Nitriles Organofluorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
3-phenylpyrrole - Pyrimidine-5-carboxylic acid - Pyrimidine-5-carboxylic acid or derivatives - Pyrrolopyrimidine - Phenol ether - Phenoxy compound - Alkyl aryl ether - Fluorobenzene - Halobenzene - Pyrimidone - Aralkylamine - Aryl fluoride - Pyrimidine - Benzenoid - Pyridine - Aryl halide - Monocyclic benzene moiety - Heteroaromatic compound - Vinylogous amide - Tertiary aliphatic amine - Tertiary amine - Carboxylic acid ester - Amino acid or derivatives - Lactam - Azacycle - Carboxylic acid derivative - Ether - Carbonitrile - Nitrile - Amine - Organooxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Organonitrogen compound - Organofluoride - Organic oxide - Cyanide - Organohalogen 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