Compound Identification
SMILES
ClC1=CC(Cl)=C(C=C1)C1=NN(C2CC(=O)C3OCC2O3)C(=S)N1CC=C
InChIKey
InChIKey=ATZDCMHHZHHVHZ-UHFFFAOYSA-N
Formula
C17H15Cl2N3O3S
Mass
412.29
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Azoles
-
Subclass
Triazoles
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Level 5
Phenyltriazoles
- Level 6 Phenyl-1,2,4-triazoles
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Level 5
Phenyltriazoles
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Subclass
Triazoles
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Class
Azoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Azoles
Subclass
Triazoles
Intermediate Tree Nodes
Phenyltriazoles
Direct Parent
Phenyl-1,2,4-triazoles
Alternative Parents
Dichlorobenzenes Oxepanes Oxanes Aryl chlorides 1,3-dioxolanes Heteroaromatic compounds Ketones Oxacyclic compounds Acetals Azacyclic compounds Organonitrogen compounds Organopnictogen compounds Aldehydes Organosulfur compounds Hydrocarbon derivatives Organochlorides Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenyl-1,2,4-triazole - 1,3-dichlorobenzene - Oxepane - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Oxane - Meta-dioxolane - Heteroaromatic compound - Ketone - Acetal - Oxacycle - Azacycle - Organic nitrogen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Aldehyde - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenyl-1,2,4-triazoles. These are organic compounds containing a 1,2,4-triazole substituted by a phenyl group.
External Descriptors
Not available