Compound Identification
SMILES
[O-][N+](=O)C1=CC=CC=C1C1=CSC(=N1)C1CCN(CC1)C(=O)NC1=CC(Cl)=NC(Cl)=C1
InChIKey
InChIKey=OKLPDEICMHMSNJ-UHFFFAOYSA-N
Formula
C20H17Cl2N5O3S
Mass
478.35
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
Piperidinecarboxamides Polyhalopyridines Nitroaromatic compounds 2,4-disubstituted thiazoles 2-halopyridines Aryl chlorides Heteroaromatic compounds Ureas Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Hydrocarbon derivatives Organic oxides Carbonyl compounds Organic salts Organic zwitterions Organochlorides Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Nitrobenzene - 1-piperidinecarboxamide - Piperidinecarboxamide - Nitroaromatic compound - Polyhalopyridine - 2,4-disubstituted 1,3-thiazole - 2-halopyridine - Aryl chloride - Aryl halide - Piperidine - Pyridine - Azole - Heteroaromatic compound - Thiazole - Urea - Organic nitro compound - C-nitro compound - Allyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organoheterocyclic compound - Azacycle - Organic oxoazanium - Organic salt - Organonitrogen compound - Organochloride - Organooxygen compound - Organohalogen compound - Hydrocarbon derivative - Carbonyl group - Organic nitrogen compound - Organic oxide - Organic oxygen compound - Organic zwitterion - Aromatic heteromonocyclic 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