Compound Identification
SMILES
COC1=CC(Br)=C(C=C1OC)S(=O)(=O)N1CCCN(CC1)C(=O)C1=CC(C)=CC=C1
InChIKey
InChIKey=SMALZKUKGCPMBR-UHFFFAOYSA-N
Formula
C21H25BrN2O5S
Mass
497.4
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Toluenes
-
Level 5
Toluamides
-
Level 6
m-Toluamides
- Level 7 N,N-dialkyl-m-toluamides
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Level 6
m-Toluamides
-
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 - m-Toluamides
Direct Parent
N,N-dialkyl-m-toluamides
Alternative Parents
Benzenesulfonamides Dimethoxybenzenes Benzamides Benzenesulfonyl compounds Anisoles Phenoxy compounds Benzoyl derivatives 1,4-diazepanes Alkyl aryl ethers Bromobenzenes Aryl bromides Organosulfonamides Tertiary carboxylic acid amides Sulfonyls Tertiary amines Amino acids and derivatives Azacyclic compounds Organobromides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N,n-dialkyl-m-toluamide - Benzenesulfonamide - Dimethoxybenzene - O-dimethoxybenzene - Benzamide - Benzoic acid or derivatives - Benzenesulfonyl group - Anisole - Methoxybenzene - Benzoyl - Phenoxy compound - Phenol ether - 1,4-diazepane - Alkyl aryl ether - Bromobenzene - Diazepane - Halobenzene - Organosulfonic acid amide - Aryl bromide - Aryl halide - Organic sulfonic acid or derivatives - Tertiary carboxylic acid amide - Sulfonyl - Organosulfonic acid or derivatives - Tertiary amine - Amino acid or derivatives - Carboxamide group - Organoheterocyclic compound - Azacycle - Ether - Carboxylic acid derivative - Organosulfur compound - Organic oxide - Organic nitrogen compound - Amine - Organic oxygen compound - Hydrocarbon derivative - Organohalogen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as n,n-dialkyl-m-toluamides. These are aromatic that contain a m-toluamide, where the carboxamide group is N- substituted with two alkyl chains.
External Descriptors
Not available