Compound Identification
SMILES
CC(=O)N(C1=C(C)C(C)=NO1)[S+](O)([O-])=C1C=CC(=N)C=C1
InChIKey
InChIKey=JOKBXVPZGBSSJF-UHFFFAOYSA-N
Formula
C13H15N3O4S
Mass
309.34
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Azoles
- Subclass Isoxazoles
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Class
Azoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Azoles
Subclass
Isoxazoles
Intermediate Tree Nodes
Not available
Direct Parent
Isoxazoles
Alternative Parents
Thioketone s-oxides Heteroaromatic compounds Acetamides Ketimines Oxacyclic compounds Azacyclic compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Isoxazole - Thioketone-s-oxide - Acetamide - Heteroaromatic compound - Ketimine - Thioketone - Oxacycle - Azacycle - Carboxylic acid derivative - Organopnictogen compound - Carbonyl group - Organic oxygen compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Imine - Organic oxide - Hydrocarbon derivative - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as isoxazoles. These are heterocyclic organic compounds containing an isoxazole moiety, with a structure characterized by a five-member aromatic ring with one oxygen atom and one nitrogen atom at ring positions 1 and 2, respectively.
External Descriptors
Not available