Compound Identification
SMILES
OC(=O)C1N2[C@@H](SC=C1COC(=O)NC1=CC(Cl)=CC=C1)C(NC(=O)CC1=CC=CC=C1)C2=O
InChIKey
InChIKey=MNSFNBJZHXUNEH-GRERDSQWSA-N
Formula
C23H20ClN3O6S
Mass
501.94
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Carboxylic acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
- Level 5 Amino acids and derivatives
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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
N-acyl-alpha amino acids and derivatives
Alternative Parents
Phenylcarbamic acid esters Phenylacetamides Chlorobenzenes 1,3-thiazines Aryl chlorides Beta lactams Carbamate esters Tertiary carboxylic acid amides Thioenol ethers Amino acids Azetidines Tertiary amines Secondary carboxylic acid amides Monocarboxylic acids and derivatives Carboxylic acids Thiohemiaminal derivatives Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-acyl-alpha amino acid or derivatives - Phenylcarbamic acid ester - Phenylacetamide - Chlorobenzene - Halobenzene - Meta-thiazine - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Beta-lactam - Carbamic acid ester - Tertiary carboxylic acid amide - Azetidine - Amino acid - Carboxamide group - Lactam - Secondary carboxylic acid amide - Tertiary amine - Thioenolether - Hemithioaminal - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Azacycle - Carboxylic acid - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organic oxide - Organic nitrogen compound - Amine - 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