Compound Identification
SMILES
[Na+].CCC(=O)[N-]S(=O)(=O)C1=C(COC(=O)CC)C=C(C=C1)N1N=C(C=C1C1=CC=C(Br)C=C1)C(F)(F)F
InChIKey
InChIKey=CUAIOEQQOQYCHP-UHFFFAOYSA-M
Formula
C23H20BrF3N3NaO5S
Mass
610.38
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
Benzenesulfonamides Benzyloxycarbonyls Benzenesulfonyl compounds Bromobenzenes Aryl bromides Sulfonyls Organosulfonic acids and derivatives Heteroaromatic compounds Carboxylic acid esters Azacyclic compounds Organic metal halides Monocarboxylic acids and derivatives Carbene-type 1,3-dipolar compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organic sodium salts Organic zwitterions Organobromides Organofluorides Organonitrogen compounds Alkyl fluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenylpyrazole - Benzyloxycarbonyl - Benzenesulfonamide - Benzenesulfonyl group - Halobenzene - Bromobenzene - Aryl halide - Benzenoid - Aryl bromide - Monocyclic benzene moiety - Heteroaromatic compound - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Carboxylic acid ester - Azacycle - Organic alkali metal salt - Monocarboxylic acid or derivatives - Organic 1,3-dipolar compound - Carbene-type 1,3-dipolar compound - Carboxylic acid derivative - Organic metal halide - Alkyl fluoride - Organofluoride - Organobromide - Organohalogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic zwitterion - Carbonyl group - Organic salt - Organic sodium salt - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Alkyl halide - Aromatic heteromonocyclic 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