Compound Identification
SMILES
FC(F)(F)C1=C(Cl)C=CC(NC(=O)CN2CCN(CC2)C(=S)NCC2=CC3=C(OCO3)C=C2)=C1
InChIKey
InChIKey=CPSRHEKKLUHWEN-UHFFFAOYSA-N
Formula
C22H22ClF3N4O3S
Mass
514.95
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
-
Subclass
Amino acids, peptides, and analogues
-
Class
Carboxylic acids and derivatives
-
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
Trifluoromethylbenzenes N-piperazineacetamides Anilides Benzodioxoles N-arylamides N-alkylpiperazines Chlorobenzenes Aryl chlorides Secondary carboxylic acid amides Thioureas Trialkylamines Acetals Azacyclic compounds Oxacyclic compounds Organopnictogen compounds Organofluorides Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid amide - N-piperazineacetamide - Trifluoromethylbenzene - Benzodioxole - Anilide - N-arylamide - Halobenzene - Chlorobenzene - N-alkylpiperazine - Aryl chloride - 1,4-diazinane - Aryl halide - Monocyclic benzene moiety - Piperazine - Benzenoid - Tertiary amine - Secondary carboxylic acid amide - Carboxamide group - Thiourea - Tertiary aliphatic amine - Oxacycle - Azacycle - Acetal - Organoheterocyclic compound - Organic nitrogen compound - Organohalogen compound - Organochloride - Organofluoride - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Amine - Organic oxygen compound - Alkyl halide - Alkyl fluoride - Aromatic heteropolycyclic 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