Compound Identification
SMILES
CC(=O)N1CCC2=C(C1)C(=NN2CC(O)CN1CCC(CC1)OC1=CC(Cl)=CC=C1)C1=CC=C(Br)C=C1
InChIKey
InChIKey=UFTJXTPHYLCMBK-UHFFFAOYSA-N
Formula
C28H32BrClN4O3
Mass
587.94
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Azoles
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Subclass
Pyrazoles
- Level 5 Phenylpyrazoles
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Subclass
Pyrazoles
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Class
Azoles
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Azoles
Subclass
Pyrazoles
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyrazoles
Alternative Parents
Phenol ethers Phenoxy compounds Alkyl aryl ethers Bromobenzenes Chlorobenzenes Aryl bromides Aryl chlorides Piperidines Heteroaromatic compounds Tertiary carboxylic acid amides Acetamides Secondary alcohols 1,2-aminoalcohols Amino acids and derivatives Trialkylamines Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Organobromides Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenylpyrazole - Phenoxy compound - Phenol ether - Alkyl aryl ether - Bromobenzene - Chlorobenzene - Halobenzene - Aryl bromide - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Piperidine - Heteroaromatic compound - Acetamide - Tertiary carboxylic acid amide - 1,2-aminoalcohol - Amino acid or derivatives - Tertiary aliphatic amine - Carboxamide group - Tertiary amine - Secondary alcohol - Ether - Carboxylic acid derivative - Azacycle - Alcohol - Amine - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organohalogen compound - Organobromide - Organochloride - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpyrazoles. These are compounds containing a phenylpyrazole skeleton, which consists of a pyrazole bound to a phenyl group.
External Descriptors
Not available