Compound Identification
SMILES
CCN(CC)C1=CC=C(\C=N\NC(=O)C2=CC(=NN2)C2=CC=C(OCC3=CC=C(Cl)C=C3)C=C2)C=C1
InChIKey
InChIKey=KDDUQOIHEFUXBE-UXHLAJHPSA-N
Formula
C28H28ClN5O2
Mass
502.02
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
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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-5-carboxamides Phenoxy compounds Phenol ethers Dialkylarylamines Aniline and substituted anilines Chlorobenzenes Alkyl aryl ethers Aryl chlorides Heteroaromatic compounds Amino acids and derivatives Azacyclic compounds Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenylpyrazole - Phenol ether - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aniline or substituted anilines - Pyrazole-5-carboxamide - Phenoxy compound - Alkyl aryl ether - Halobenzene - Chlorobenzene - Monocyclic benzene moiety - Benzenoid - Aryl halide - Aryl chloride - Heteroaromatic compound - Amino acid or derivatives - Tertiary amine - Azacycle - Carboxylic acid derivative - Ether - Organic oxygen compound - Organooxygen compound - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organohalogen compound - Organochloride - 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