Compound Identification
SMILES
[Na+].CCC(=O)[N-]S(=O)(=O)C1=C(CO)C=C(C=C1)N1N=C(C=C1C1=CC(C)=C(OC)C=C1)C(F)(F)F
InChIKey
InChIKey=ALIFPBWSQWFKCI-UHFFFAOYSA-M
Formula
C22H21F3N3NaO5S
Mass
519.47
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 Benzenesulfonyl compounds Phenoxy compounds Anisoles Benzyl alcohols Methoxybenzenes Toluenes Alkyl aryl ethers Sulfonyls Organosulfonic acids and derivatives Heteroaromatic compounds Azacyclic compounds Organic metal halides Carbene-type 1,3-dipolar compounds Carboxylic acids and derivatives Carbonyl compounds Hydrocarbon derivatives Organic oxides Organic sodium salts Organic zwitterions Organofluorides Aromatic alcohols Organonitrogen compounds Alkyl fluorides Primary alcohols
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenylpyrazole - Benzenesulfonamide - Benzenesulfonyl group - Phenoxy compound - Anisole - Benzyl alcohol - Phenol ether - Methoxybenzene - Alkyl aryl ether - Toluene - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Organic metal halide - Carboxylic acid derivative - Ether - Azacycle - Organic alkali metal salt - Organic 1,3-dipolar compound - Carbene-type 1,3-dipolar compound - Organic zwitterion - Organic oxygen compound - Alkyl halide - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Alkyl fluoride - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Primary alcohol - Organic sodium salt - Organic salt - Alcohol - Aromatic alcohol - 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