Compound Identification
SMILES
[O-][N+](=O)NC1=NCCN1CC1=CN=C(Cl)C=C1.CCS(=O)C1=C(N)N(N=C1C#N)C1=C(Cl)C=C(C=C1Cl)C(F)(F)F
InChIKey
InChIKey=QDNJCDYVFIDYMJ-UHFFFAOYSA-N
Formula
C22H19Cl3F3N9O3S
Mass
652.86
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
Trifluoromethylbenzenes Dichlorobenzenes 2-halopyridines Nitroguanidines Aryl chlorides Heteroaromatic compounds Imidazolines Nitramines Sulfoxides Sulfinyl compounds Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Carboximidamides Nitriles Hydrocarbon derivatives Organochlorides Organofluorides Organic zwitterions Organic salts Primary amines Alkyl fluorides Organic oxides
Molecular Framework
Not available
Substituents
Phenylpyrazole - Trifluoromethylbenzene - 1,3-dichlorobenzene - Nitroguanidine - 2-halopyridine - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Pyridine - Benzenoid - Heteroaromatic compound - Nitramine - 2-imidazoline - Organic nitro compound - Guanidine - Sulfoxide - Sulfinyl compound - Azacycle - Organic 1,3-dipolar compound - Carbonitrile - Nitrile - Carboximidamide - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Alkyl fluoride - Organochloride - Organohalogen compound - Organofluoride - Organonitrogen compound - Organosulfur compound - Primary amine - Organic zwitterion - Organic salt - Hydrocarbon derivative - Organic oxide - Cyanide - Organic oxygen compound - Organic nitrogen compound - Amine - 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