Compound Identification
SMILES
O[C@@H]1[C@@H](O)[C@@H](CC2=CC=C(O)C=C2)N(CC2=CC=CC(=C2)C2=CC=NN2)C(=O)N(CC2=CC=CC(=C2)C2=CC=NN2)[C@@H]1CC1=CC=C(O)C=C1
InChIKey
InChIKey=NIEAPINYNLFWMC-RNATXAOGSA-N
Formula
C39H38N6O5
Mass
670.77
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
1-hydroxy-2-unsubstituted benzenoids 1,3-diazepanes Benzene and substituted derivatives Heteroaromatic compounds Ureas Secondary alcohols 1,2-diols Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenylpyrazole - 1,3-diazepane - 1-hydroxy-2-unsubstituted benzenoid - Diazepane - Phenol - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - 1,2-diol - Urea - Secondary alcohol - Carbonic acid derivative - Azacycle - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organopnictogen compound - Carbonyl group - Organic oxygen compound - Alcohol - Organic nitrogen 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