Compound Identification
SMILES
CN1C(CNC2=CC=C(Cl)C=C2)=NN=C1SCC(=O)NC1=C(C)C=C(C=C1)[N+]([O-])=O
InChIKey
InChIKey=HLCMVWQKYQYFTJ-UHFFFAOYSA-N
Formula
C19H19ClN6O3S
Mass
446.91
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
Anilides Nitrotoluenes Aniline and substituted anilines N-arylamides Nitroaromatic compounds Phenylalkylamines Secondary alkylarylamines Alkylarylthioethers Chlorobenzenes Aryl chlorides Triazoles Heteroaromatic compounds Secondary carboxylic acid amides Amino acids and derivatives Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Sulfenyl compounds Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organic salts Organic zwitterions Organochlorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Nitrobenzene - Anilide - Nitrotoluene - N-arylamide - Aniline or substituted anilines - Phenylalkylamine - Aryl thioether - Nitroaromatic compound - Aralkylamine - Alkylarylthioether - Chlorobenzene - Halobenzene - Secondary aliphatic/aromatic amine - Toluene - Aryl halide - Aryl chloride - Heteroaromatic compound - Azole - 1,2,4-triazole - Organic nitro compound - Amino acid or derivatives - Carboxamide group - C-nitro compound - Secondary carboxylic acid amide - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Secondary amine - Thioether - Sulfenyl compound - Organohalogen compound - Organic nitrogen compound - Organic oxide - Organic oxygen compound - Carbonyl group - Organochloride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic zwitterion - Organic salt - Amine - Hydrocarbon derivative - 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