Compound Identification
SMILES
CN(C(C)=O)C1=CC=C(C=C1)N=NC1C(C)=NN(C1=O)C1=NC(=CS1)C1=CC=C(Br)C=C1
InChIKey
InChIKey=VELCCURPEAHQQP-UHFFFAOYSA-N
Formula
C22H19BrN6O2S
Mass
511.4
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
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Class
Benzene and substituted derivatives
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Subclass
Anilides
- Level 5 Acetanilides
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Subclass
Anilides
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Anilides
Intermediate Tree Nodes
Not available
Direct Parent
Acetanilides
Alternative Parents
Alpha amino acids and derivatives Bromobenzenes 2,4-disubstituted thiazoles Pyrazolones Aryl bromides Tertiary carboxylic acid amides Heteroaromatic compounds Acetamides Azo compounds Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organobromides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alpha-amino acid or derivatives - Acetanilide - 2,4-disubstituted 1,3-thiazole - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Pyrazolinone - Heteroaromatic compound - Acetamide - Azole - Thiazole - Tertiary carboxylic acid amide - Pyrazoline - Azo compound - Carboxamide group - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Carbonyl group - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organonitrogen compound - Organohalogen compound - Organobromide - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as acetanilides. These are organic compounds containing an acetamide group conjugated to a phenyl group.
External Descriptors
Not available