Compound Identification
SMILES
CC(=O)NC1=NC(SCC2=CC=CC=C2)=C(C(Cl)=N1)[N+]([O-])=O
InChIKey
InChIKey=POZCILZGMBWJBG-UHFFFAOYSA-N
Formula
C13H11ClN4O3S
Mass
338.77
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organic nitrogen compounds
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Class
Organonitrogen compounds
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Subclass
N-arylamides
- Level 5 N-acetylarylamines
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Subclass
N-arylamides
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Class
Organonitrogen compounds
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Superclass
Organic nitrogen compounds
Kingdom
Organic compounds
Superclass
Organic nitrogen compounds
Class
Organonitrogen compounds
Subclass
N-arylamides
Intermediate Tree Nodes
Not available
Direct Parent
N-acetylarylamines
Alternative Parents
Nitroaromatic compounds Alkylarylthioethers Halopyrimidines Aryl chlorides Benzene and substituted derivatives Heteroaromatic compounds Acetamides Secondary carboxylic acid amides Organic oxoazanium compounds Propargyl-type 1,3-dipolar organic compounds Sulfenyl compounds Azacyclic compounds Organic zwitterions Organic oxides Hydrocarbon derivatives Carbonyl compounds Organochlorides Organopnictogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-acetylarylamine - Aryl thioether - Nitroaromatic compound - Halopyrimidine - Alkylarylthioether - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Pyrimidine - Benzenoid - Heteroaromatic compound - Acetamide - C-nitro compound - Carboxamide group - Secondary carboxylic acid amide - Organic nitro compound - Azacycle - Carboxylic acid derivative - Sulfenyl compound - Thioether - Organic oxoazanium - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organoheterocyclic compound - Organic oxygen compound - Organochloride - Organohalogen compound - Organooxygen compound - Organosulfur compound - Organic zwitterion - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organopnictogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as n-acetylarylamines. These are acetamides where one or more amide hydrogens is substituted by an aryl group.
External Descriptors
Not available