Compound Identification
SMILES
CC1=NN=C(SCC2=NC(=NO2)C2=CC=C(Cl)C=C2)N1C1=CC(C)=C(C)C=C1
InChIKey
InChIKey=AJMJABBPMSQDAI-UHFFFAOYSA-N
Formula
C20H18ClN5OS
Mass
411.91
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
Oxadiazoles
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Level 5
1,2,4-oxadiazoles
- Level 6 Phenyloxadiazoles
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Level 5
1,2,4-oxadiazoles
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Subclass
Oxadiazoles
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Class
Azoles
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Azoles
Subclass
Oxadiazoles
Intermediate Tree Nodes
1,2,4-oxadiazoles
Direct Parent
Phenyloxadiazoles
Alternative Parents
Phenyl-1,2,4-triazoles o-Xylenes Chlorobenzenes Alkylarylthioethers Aryl chlorides Heteroaromatic compounds Sulfenyl compounds Oxacyclic compounds Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Organochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenyltriazole - Phenyl-1,2,4-triazole - Phenyl-1,2,4-oxadiazole - Aryl thioether - Xylene - O-xylene - Halobenzene - Alkylarylthioether - Chlorobenzene - Monocyclic benzene moiety - Benzenoid - Aryl chloride - Aryl halide - 1,2,4-triazole - Heteroaromatic compound - Triazole - Oxacycle - Azacycle - Thioether - Sulfenyl compound - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organosulfur compound - Hydrocarbon derivative - Organopnictogen compound - Organic oxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenyloxadiazoles. These are polycyclic aromatic compounds containing a benzene ring linked to a 1,2,4-oxadiazole ring through a CC or CN bond.
External Descriptors
Not available