Compound Identification
SMILES
CCOC(=O)C1=NN(C2=C1NC(=O)N(C(=O)NC1=C(F)C=C(C=C1)N1C=CN=C1CN(C)C)C2=O)C1=CC=CC(=C1)C1=NC(N)=NN1
InChIKey
InChIKey=KSLDYPOAGUTGTR-UHFFFAOYSA-N
Formula
C29H27FN12O5
Mass
642.612
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
Phenylimidazoles Phenyl-1,2,4-triazoles N-phenylureas Pyrazolopyrimidines Pyrazole carboxylic acids and derivatives Imidazolyl carboxylic acids and derivatives Aralkylamines Fluorobenzenes Pyrimidones Aryl fluorides N-substituted imidazoles Vinylogous amides Heteroaromatic compounds Lactams Amino acids and derivatives Trialkylamines Carboxylic acid esters Ureas Azacyclic compounds Organooxygen compounds Primary amines Hydrocarbon derivatives Organofluorides Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-phenylimidazole - Phenylpyrazole - Phenyl-1,2,4-triazole - Phenyltriazole - N-phenylurea - Pyrazolopyrimidine - Pyrazole-5-carboxylic acid or derivatives - Pyrazole-3-carboxylic acid or derivatives - Imidazolyl carboxylic acid derivative - Fluorobenzene - Halobenzene - Aralkylamine - Pyrimidone - Aryl fluoride - Aryl halide - N-substituted imidazole - Monocyclic benzene moiety - Pyrimidine - Benzenoid - Heteroaromatic compound - Vinylogous amide - Imidazole - 1,2,4-triazole - Triazole - Amino acid or derivatives - Carboxylic acid ester - Urea - Tertiary aliphatic amine - Lactam - Tertiary amine - Azacycle - Carboxylic acid derivative - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Amine - Organic oxide - Primary amine - Organohalogen compound - Organofluoride - 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