Compound Identification
SMILES
COC1=CC(CC(=O)NNC2=CC=CC(=C2)C2=NNC(C)=C2Br)=CC(OC)=C1OC
InChIKey
InChIKey=YQBIORWLZUEUJB-UHFFFAOYSA-N
Formula
C21H23BrN4O4
Mass
475.343
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
-
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
Phenylacetamides Phenylhydrazines Phenoxy compounds Methoxybenzenes Anisoles Alkyl aryl ethers Aryl bromides Heteroaromatic compounds Carboxylic acid hydrazides Azacyclic compounds Organonitrogen compounds Organobromides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenylpyrazole - Phenylacetamide - Phenoxy compound - Anisole - Phenol ether - Phenylhydrazine - Methoxybenzene - Alkyl aryl ether - Monocyclic benzene moiety - Aryl bromide - Aryl halide - Benzenoid - Heteroaromatic compound - Carboxylic acid hydrazide - Carboxylic acid derivative - Azacycle - Ether - Organic nitrogen compound - Organohalogen compound - Organobromide - Organonitrogen compound - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen 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