Compound Identification
SMILES
[O-][N+](=O)C1=CC2=C(C=C1)C1=C(C=C(C(=C1)C#N)[N+]([O-])=O)S2=O
InChIKey
InChIKey=DTYRKZPJCXPKJH-UHFFFAOYSA-N
Formula
C13H5N3O5S
Mass
315.26
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Benzothiophenes
- Subclass Dibenzothiophenes
-
Class
Benzothiophenes
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzothiophenes
Subclass
Dibenzothiophenes
Intermediate Tree Nodes
Not available
Direct Parent
Dibenzothiophenes
Alternative Parents
1-benzothiophenes Nitroaromatic compounds Thiophene sulfoxides Benzenoids Heteroaromatic compounds Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Nitriles Organic salts Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Dibenzothiophene - 1-benzothiophene - Nitroaromatic compound - Thiophene sulfoxide - Benzenoid - Thiophene - Heteroaromatic compound - C-nitro compound - Organic nitro compound - Carbonitrile - Nitrile - Organic oxoazanium - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organic oxide - Cyanide - Organonitrogen compound - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Organic salt - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as dibenzothiophenes. These are organic heterocyclic compounds with a structure containing a dibenzothiophene moiety, made up of two benzene rings fused to a central thiophene ring.
External Descriptors
Not available