Compound Identification
SMILES
COC1=C(OC)C=C(CCNC(=O)CNC2=C(C=CC(Cl)=C2)S(N)(=O)=O)C=C1
InChIKey
InChIKey=LWXJTNGFZTWVEG-UHFFFAOYSA-N
Formula
C18H22ClN3O5S
Mass
427.9
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
Amino acids, peptides, and analogues
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Level 5
Amino acids and derivatives
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Level 6
Alpha amino acids and derivatives
- Level 7 Alpha amino acid amides
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Level 6
Alpha amino acids and derivatives
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Level 5
Amino acids and derivatives
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Subclass
Amino acids, peptides, and analogues
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Class
Carboxylic acids and derivatives
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Superclass
Organic acids and derivatives
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Carboxylic acids and derivatives
Subclass
Amino acids, peptides, and analogues
Intermediate Tree Nodes
Amino acids and derivatives - Alpha amino acids and derivatives
Direct Parent
Alpha amino acid amides
Alternative Parents
Aminobenzenesulfonamides Dimethoxybenzenes Benzenesulfonyl compounds Aniline and substituted anilines Anisoles Phenylalkylamines Phenoxy compounds Chlorobenzenes Secondary alkylarylamines Alkyl aryl ethers Aryl chlorides Organosulfonamides Aminosulfonyl compounds Secondary carboxylic acid amides Hydrocarbon derivatives Carbonyl compounds Organic oxides Organochlorides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Alpha-amino acid amide - Aminobenzenesulfonamide - Benzenesulfonamide - Dimethoxybenzene - O-dimethoxybenzene - Benzenesulfonyl group - Phenoxy compound - Anisole - Phenol ether - Aniline or substituted anilines - Phenylalkylamine - Methoxybenzene - Alkyl aryl ether - Chlorobenzene - Halobenzene - Secondary aliphatic/aromatic amine - Organosulfonic acid amide - Benzenoid - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Organic sulfonic acid or derivatives - Aminosulfonyl compound - Sulfonyl - Organosulfonic acid or derivatives - Secondary carboxylic acid amide - Carboxamide group - Secondary amine - Ether - Organic nitrogen compound - Hydrocarbon derivative - Carbonyl group - Organic oxygen compound - Organic oxide - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Amine - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as alpha amino acid amides. These are amide derivatives of alpha amino acids.
External Descriptors
Not available