Compound Identification
SMILES
OC(=O)N1CCC2=C(C1)C(=NN2CCCN1CCC(CC1)N1C(=O)NC2=CC=CC=C12)C1=CC=C(Br)C=C1
InChIKey
InChIKey=CXCQAGSFKITVLH-UHFFFAOYSA-N
Formula
C28H31BrN6O3
Mass
579.499
Taxonomic Classification
Taxonomy Tree
-
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
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Azoles
Subclass
Pyrazoles
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyrazoles
Alternative Parents
Benzimidazoles Bromobenzenes Piperidines N-substituted imidazoles Aryl bromides Heteroaromatic compounds Ureas Trialkylamines Carbamic acids Azacyclic compounds Organobromides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenylpyrazole - Benzimidazole - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Benzenoid - N-substituted imidazole - Piperidine - Heteroaromatic compound - Imidazole - Carbamic acid - Carbamic acid derivative - Urea - Tertiary aliphatic amine - Tertiary amine - Azacycle - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Amine - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Organobromide - 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