Compound Identification
SMILES
OC(=O)c1cc(-c2ccc(cc2)C(=S)NCc2ccc(cc2Cl)-c2ccc(o2)C(O)=O)n(n1)-c1ccc(Cl)c(Cl)c1
InChIKey
InChIKey=POUUEODRHCAGGO-UHFFFAOYSA-N
Formula
C29H18Cl3N3O5S
Mass
626.89
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
Pyrazole carboxylic acids and derivatives Dichlorobenzenes Furoic acids Aryl chlorides Dicarboxylic acids and derivatives Thioamides Heteroaromatic compounds Thiocarboxylic acid amides Azacyclic compounds Carboxylic acids Oxacyclic compounds Organooxygen compounds Organopnictogen compounds Thiocarbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenylpyrazole - Furoic acid or derivatives - 1,2-dichlorobenzene - Furoic acid - Pyrazole-3-carboxylic acid or derivatives - Pyrazole-5-carboxylic acid or derivatives - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Benzenoid - Heteroaromatic compound - Furan - Thioamide - Carboxylic acid derivative - Carboxylic acid - Oxacycle - Azacycle - Thiocarboxylic acid amide - Thiocarbonyl group - Organopnictogen compound - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - 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