Compound Identification
SMILES
NC(=N)SC1=C(Cl)C=C(C=C1)[N+]([O-])=O
InChIKey
InChIKey=TUFPHAVRIOCSHB-UHFFFAOYSA-N
Formula
C7H6ClN3O2S
Mass
231.65
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Nitrobenzenes
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Nitrobenzenes
Intermediate Tree Nodes
Not available
Direct Parent
Nitrobenzenes
Alternative Parents
Nitroaromatic compounds Aryl thioethers Chlorobenzenes Aryl chlorides Isothioureas Sulfenyl compounds Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Carboximidamides Organochlorides Organic salts Organic oxides Imines Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Nitrobenzene - Aryl thioether - Nitroaromatic compound - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Isothiourea - C-nitro compound - Organic nitro compound - Allyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Sulfenyl compound - Carboximidamide - Propargyl-type 1,3-dipolar organic compound - Organic oxoazanium - Organic salt - Organosulfur compound - Organochloride - Organonitrogen compound - Organohalogen compound - Organic oxygen compound - Organic nitrogen compound - Imine - Hydrocarbon derivative - Organic oxide - Organic cation - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as nitrobenzenes. These are compounds containing a nitrobenzene moiety, which consists of a benzene ring with a carbon bearing a nitro group.
External Descriptors
Not available