Compound Identification
SMILES
FC1=CC=C(C=C1)N1C=C(SC2=CC=C(Cl)C=C2)C(=N1)C1=CN=C(C=N1)N1C=NC=N1
InChIKey
InChIKey=YXMXDSQZPAWEJD-UHFFFAOYSA-N
Formula
C21H13ClFN7S
Mass
449.89
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
Diarylthioethers Thiophenol ethers Fluorobenzenes Chlorobenzenes Pyrazines Aryl fluorides Aryl chlorides Triazoles Heteroaromatic compounds Sulfenyl compounds Azacyclic compounds Organonitrogen compounds Organofluorides Organochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenylpyrazole - Diarylthioether - Aryl thioether - Thiophenol ether - Chlorobenzene - Fluorobenzene - Halobenzene - Pyrazine - Benzenoid - Aryl halide - Monocyclic benzene moiety - Aryl chloride - Aryl fluoride - 1,2,4-triazole - Heteroaromatic compound - Sulfenyl compound - Azacycle - Thioether - Hydrocarbon derivative - Organohalogen compound - Organochloride - Organofluoride - Organonitrogen compound - Organosulfur compound - 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