Compound Identification
SMILES
CCOC(=O)C(C)N1C(=O)SC(=CC2=CC=C(O2)SC2=NC3=CC=CC=C3N2)C1=O
InChIKey
InChIKey=HTKUWTUBUHDXIZ-UHFFFAOYSA-N
Formula
C20H17N3O5S2
Mass
443.49
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
-
Level 6
Alpha amino acids and derivatives
- Level 7 Alpha amino acid esters
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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 esters
Alternative Parents
Alanine and derivatives Diarylthioethers Benzimidazoles Thiazolidinediones Benzenoids Imidazoles Heteroaromatic compounds Furans Dicarboximides Thiocarbamic acid derivatives Carboxylic acid esters Sulfenyl compounds Oxacyclic compounds Azacyclic compounds Monocarboxylic acids and derivatives Carbonyl compounds Hydrocarbon derivatives Organic oxides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid ester - Alanine or derivatives - Diarylthioether - Benzimidazole - Aryl thioether - Thiazolidinedione - Benzenoid - Azole - Dicarboximide - Heteroaromatic compound - Furan - Imidazole - Thiazolidine - Carboxylic acid ester - Thiocarbamic acid derivative - Sulfenyl compound - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Azacycle - Oxacycle - Thioether - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic nitrogen compound - Carbonyl group - Organic oxide - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as alpha amino acid esters. These are ester derivatives of alpha amino acids.
External Descriptors
Not available