Compound Identification
SMILES
COC1=CC(OC)=CC(NC2CCN(CC(O)CN3N=C(C4=C3CCN(C4)C(C)=O)C3=CC=C(Cl)C=C3)CC2)=C1
InChIKey
InChIKey=DPUARDKHCTZEPU-UHFFFAOYSA-N
Formula
C30H38ClN5O4
Mass
568.12
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Azoles
-
Subclass
Pyrazoles
- Level 5 Phenylpyrazoles
-
Subclass
Pyrazoles
-
Class
Azoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Azoles
Subclass
Pyrazoles
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyrazoles
Alternative Parents
Dimethoxybenzenes Aminophenyl ethers Methoxyanilines Anisoles Phenylalkylamines Phenoxy compounds Alkyl aryl ethers Aminopiperidines Chlorobenzenes Secondary alkylarylamines Aryl chlorides Heteroaromatic compounds Tertiary carboxylic acid amides Acetamides Amino acids and derivatives 1,2-aminoalcohols Trialkylamines Secondary alcohols Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenylpyrazole - M-dimethoxybenzene - Dimethoxybenzene - Aminophenyl ether - Methoxyaniline - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Phenylalkylamine - Aniline or substituted anilines - Alkyl aryl ether - 4-aminopiperidine - Chlorobenzene - Halobenzene - Secondary aliphatic/aromatic amine - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Piperidine - Benzenoid - Acetamide - Tertiary carboxylic acid amide - Heteroaromatic compound - Secondary alcohol - Tertiary aliphatic amine - Tertiary amine - Amino acid or derivatives - 1,2-aminoalcohol - Carboxamide group - Azacycle - Secondary amine - Ether - Carboxylic acid derivative - Amine - Carbonyl group - Organic nitrogen compound - Alcohol - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - 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