Compound Identification
SMILES
COC(=O)CN1C=CC2=C1C=CC(SCC1=CC3=C(OC(=N3)C3=CC(F)=CC=C3)C=C1)=C2
InChIKey
InChIKey=DRSAZHIVGRHTOJ-UHFFFAOYSA-N
Formula
C25H19FN2O3S
Mass
446.5
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
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
-
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
Indolyl carboxylic acids and derivatives Phenyl-1,3-oxazoles N-alkylindoles Benzoxazoles Indoles Thiophenol ethers Alkylarylthioethers Fluorobenzenes Substituted pyrroles Aryl fluorides Heteroaromatic compounds Methyl esters Sulfenyl compounds Azacyclic compounds Monocarboxylic acids and derivatives Oxacyclic compounds Organic oxides Hydrocarbon derivatives Organofluorides Carbonyl compounds Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid ester - Indolyl carboxylic acid derivative - Phenyl-1,3-oxazole - N-alkylindole - Indole or derivatives - Benzoxazole - Indole - Aryl thioether - Thiophenol ether - Fluorobenzene - Halobenzene - Alkylarylthioether - Benzenoid - Monocyclic benzene moiety - Aryl halide - Aryl fluoride - Substituted pyrrole - Azole - Heteroaromatic compound - Methyl ester - Oxazole - Pyrrole - Carboxylic acid ester - Thioether - Oxacycle - Azacycle - Organoheterocyclic compound - Sulfenyl compound - Monocarboxylic acid or derivatives - Organic oxide - Organic nitrogen compound - Organonitrogen compound - Carbonyl group - Organosulfur compound - Organic oxygen compound - Organooxygen compound - Hydrocarbon derivative - Organohalogen compound - Organofluoride - 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