Compound Identification
SMILES
COC1=CC(C)=C(SC2=CN=C(NC3=CC(=NC(C)=N3)N(C)CCN(C)C)S2)C=C1C(=O)N1CCN(CC1)C(C)=O
InChIKey
InChIKey=KZDHXFCVANAYQN-UHFFFAOYSA-N
Formula
C28H38N8O3S2
Mass
598.79
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Toluenes
-
Level 5
Toluamides
-
Level 6
p-Toluamides
- Level 7 N,N-dialkyl-p-toluamides
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Level 6
p-Toluamides
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Level 5
Toluamides
-
Subclass
Toluenes
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Toluenes
Intermediate Tree Nodes
Toluamides - p-Toluamides
Direct Parent
N,N-dialkyl-p-toluamides
Alternative Parents
Diarylthioethers M-sulfanylbenzoic acids and derivatives Benzamides Anisoles Benzoyl derivatives Dialkylarylamines Thiophenol ethers Methoxybenzenes Phenoxy compounds Alkyl aryl ethers 2,5-disubstituted thiazoles Aminopyrimidines and derivatives Imidolactams 2-amino-1,3-thiazoles Piperazines Heteroaromatic compounds Acetamides Tertiary carboxylic acid amides Trialkylamines Amino acids and derivatives Azacyclic compounds Sulfenyl compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Diarylthioether - N,n-dialkyl-p-toluamide - M-sulfanylbenzoic acid or derivatives - Benzoic acid or derivatives - Benzamide - Phenol ether - Benzoyl - Thiophenol ether - Phenoxy compound - Aryl thioether - Dialkylarylamine - Methoxybenzene - Anisole - Alkyl aryl ether - 2,5-disubstituted 1,3-thiazole - Aminopyrimidine - Imidolactam - Pyrimidine - 1,3-thiazol-2-amine - 1,4-diazinane - Piperazine - Tertiary carboxylic acid amide - Thiazole - Acetamide - Azole - Heteroaromatic compound - Amino acid or derivatives - Tertiary aliphatic amine - Carboxamide group - Tertiary amine - Ether - Thioether - Carboxylic acid derivative - Sulfenyl compound - Organoheterocyclic compound - Azacycle - Amine - Carbonyl group - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as n,n-dialkyl-p-toluamides. These are aromatic that contain a m-toluamide, where the carboxamide group is N- substituted with two alkyl chains.
External Descriptors
Not available