Compound Identification
SMILES
CN1C(=O)N(C2CCN(CCCN3N=C(C4=C3CCN(C4)C(S)=O)C3=CC=C(C=C3)C(F)(F)F)CC2)C2=CC=CC=C12
InChIKey
InChIKey=PMDVXVCVMVDJAA-UHFFFAOYSA-N
Formula
C30H33F3N6O2S
Mass
598.69
Taxonomic Classification
Taxonomy Tree
-
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
Trifluoromethylbenzenes Benzimidazoles Piperidines N-substituted imidazoles Heteroaromatic compounds Ureas Trialkylamines Thiocarbamic acid derivatives Azacyclic compounds Organofluorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenylpyrazole - Trifluoromethylbenzene - Benzimidazole - Monocyclic benzene moiety - N-substituted imidazole - Piperidine - Benzenoid - Imidazole - Heteroaromatic compound - Tertiary aliphatic amine - Thiocarbamic acid derivative - Tertiary amine - Urea - Azacycle - Alkyl halide - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Organic oxide - Alkyl fluoride - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Amine - Hydrocarbon derivative - 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