Compound Identification
SMILES
O=C(CN1CCCN(CC1)C(=O)C1CCN(CC1)C1=NC2=CC=CC=C2S1)OCC1=CC=CC=C1
InChIKey
InChIKey=ZLPUJKUYOBIHHX-UHFFFAOYSA-N
Formula
C27H32N4O3S
Mass
492.64
Taxonomic Classification
Taxonomy Tree
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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
Benzyloxycarbonyls Piperidinecarboxamides Benzothiazoles Dialkylarylamines 1,4-diazepanes 2-amino-1,3-thiazoles Tertiary carboxylic acid amides Heteroaromatic compounds Trialkylamines Carboxylic acid esters Monocarboxylic acids and derivatives Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid ester - Benzyloxycarbonyl - 1,3-benzothiazole - Piperidinecarboxamide - Dialkylarylamine - 1,4-diazepane - Diazepane - Monocyclic benzene moiety - 1,3-thiazol-2-amine - Benzenoid - Piperidine - Azole - Heteroaromatic compound - Tertiary carboxylic acid amide - Thiazole - Carboxylic acid ester - Carboxamide group - Tertiary aliphatic amine - Tertiary amine - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Azacycle - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Carbonyl group - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Amine - 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