Compound Identification
SMILES
CC(C)C(NC(=O)C1=CC2=CC=CC=C2N=C1)C(=O)NC1CCCN(CC1=O)S(=O)(=O)C1=CC(Cl)=C(Cl)C=C1
InChIKey
InChIKey=YFUJWLBACHGEQM-UHFFFAOYSA-N
Formula
C27H28Cl2N4O5S
Mass
591.5
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
- 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
N-acyl-alpha amino acids and derivatives
Alternative Parents
Valine and derivatives Quinoline-3-carboxamides Alpha amino acid amides Benzenesulfonamides Benzenesulfonyl compounds Pyridinecarboxylic acids and derivatives Dichlorobenzenes Azepanes N-acyl amines Organosulfonamides Aryl chlorides Heteroaromatic compounds Sulfonyls Cyclic ketones Secondary carboxylic acid amides Azacyclic compounds Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-acyl-alpha amino acid or derivatives - Valine or derivatives - Quinoline-3-carboxamide - Alpha-amino acid amide - Benzenesulfonamide - Quinoline - Benzenesulfonyl group - Pyridine carboxylic acid or derivatives - 1,2-dichlorobenzene - Azepane - Chlorobenzene - Halobenzene - Fatty acyl - Aryl chloride - Benzenoid - Aryl halide - Organosulfonic acid amide - Pyridine - Monocyclic benzene moiety - Fatty amide - N-acyl-amine - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Heteroaromatic compound - Cyclic ketone - Secondary carboxylic acid amide - Carboxamide group - Ketone - Organoheterocyclic compound - Azacycle - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Organosulfur compound - Carbonyl group - Organic oxygen compound - Hydrocarbon derivative - Organochloride - Organic oxide - Organohalogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as n-acyl-alpha amino acids and derivatives. These are compounds containing an alpha amino acid (or a derivative thereof) which bears an acyl group at its terminal nitrogen atom.
External Descriptors
Not available