Compound Identification
SMILES
COC1=CC=C(OCC2=NC(=CS2)C2=CC(C(N)=O)=C(C)N2CCNC(C)=O)C=C1
InChIKey
InChIKey=AXMCUGJWWJALDR-UHFFFAOYSA-N
Formula
C21H24N4O4S
Mass
428.51
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organic acids and derivatives
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Class
Carboxylic acids and derivatives
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Subclass
Carboxylic acid derivatives
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Level 5
Carboxylic acid amides
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Level 6
Acetamides
- Level 7 N-acetyl-2-arylethylamines
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Level 6
Acetamides
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Level 5
Carboxylic acid amides
-
Subclass
Carboxylic acid derivatives
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Class
Carboxylic acids and derivatives
-
Superclass
Organic acids and derivatives
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Carboxylic acids and derivatives
Subclass
Carboxylic acid derivatives
Intermediate Tree Nodes
Carboxylic acid amides - Acetamides
Direct Parent
N-acetyl-2-arylethylamines
Alternative Parents
Pyrrole carboxamides Phenoxy compounds Methoxybenzenes Anisoles 2,4-disubstituted thiazoles Alkyl aryl ethers Substituted pyrroles Vinylogous amides Heteroaromatic compounds Secondary carboxylic acid amides Primary carboxylic acid amides Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-acetyl-2-arylethylamine - Phenoxy compound - Anisole - Pyrrole-3-carboxamide - Pyrrole-3-carboxylic acid or derivatives - Methoxybenzene - Phenol ether - 2,4-disubstituted 1,3-thiazole - Alkyl aryl ether - Monocyclic benzene moiety - Substituted pyrrole - Benzenoid - Azole - Heteroaromatic compound - Thiazole - Vinylogous amide - Pyrrole - Primary carboxylic acid amide - Secondary carboxylic acid amide - Azacycle - Ether - Organoheterocyclic compound - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organic oxide - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as n-acetyl-2-arylethylamines. These are compounds containing an acetamide group that is N-linked to an arylethylamine.
External Descriptors
Not available