Compound Identification
SMILES
C[C@H]1CCCCN1C1=NN=C2C=CC(O[C@@H]3CC[C@H](NC(=O)NC4=CC(=NN4C4=CC=CC(CN5CC(C5)N(C)C)=C4)C(C)(C)C)C4=CC=CC=C34)=CN12
InChIKey
InChIKey=OWROCRUYUWNAHR-SKCOFGHQSA-N
Formula
C42H54N10O2
Mass
730.962
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
Tetralins Triazolopyridines Benzylamines Dialkylarylamines Phenylmethylamines Aralkylamines Alkyl aryl ethers Pyridines and derivatives Piperidines Heteroaromatic compounds Triazoles Azetidines Ureas Trialkylamines Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenylpyrazole - Tetralin - Triazolopyridine - Benzylamine - Phenylmethylamine - Dialkylarylamine - Alkyl aryl ether - Aralkylamine - Benzenoid - Pyridine - Piperidine - Monocyclic benzene moiety - Heteroaromatic compound - 1,2,4-triazole - Triazole - Urea - Tertiary aliphatic amine - Tertiary amine - Azetidine - Azacycle - Ether - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Amine - 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