Compound Identification
SMILES
CC(=O)N1CCC2=C(C1)C(=NN2CC(O)CN1CCC(CC1)NC1=CC=C(C=C1)C#N)C1=CC=C(Cl)C=C1
InChIKey
InChIKey=XSODVAKNPCBNSI-UHFFFAOYSA-N
Formula
C29H33ClN6O2
Mass
533.07
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
Aniline and substituted anilines Benzonitriles Phenylalkylamines Aminopiperidines Secondary alkylarylamines Chlorobenzenes Aryl chlorides Heteroaromatic compounds Tertiary carboxylic acid amides Acetamides Secondary alcohols 1,2-aminoalcohols Trialkylamines Amino acids and derivatives Nitriles Azacyclic compounds Hydrocarbon derivatives Organochlorides Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenylpyrazole - Benzonitrile - Aniline or substituted anilines - Phenylalkylamine - 4-aminopiperidine - Chlorobenzene - Secondary aliphatic/aromatic amine - Halobenzene - Aryl halide - Aryl chloride - Monocyclic benzene moiety - Piperidine - Benzenoid - Heteroaromatic compound - Tertiary carboxylic acid amide - Acetamide - Tertiary amine - Secondary alcohol - 1,2-aminoalcohol - Amino acid or derivatives - Carboxamide group - Tertiary aliphatic amine - Secondary amine - Azacycle - Nitrile - Carboxylic acid derivative - Carbonitrile - Organic nitrogen compound - Organohalogen compound - Organochloride - Carbonyl group - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Cyanide - Organic oxygen compound - Amine - Alcohol - Aromatic heteropolycyclic 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