Compound Identification
SMILES
CCOC(=O)CCNC(=S)N1CCCN1C(=O)C1=C(Cl)N=CC=C1
InChIKey
InChIKey=DYFXECTXEGLVJW-UHFFFAOYSA-N
Formula
C15H19ClN4O3S
Mass
370.85
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 Beta 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
Direct Parent
Beta amino acids and derivatives
Alternative Parents
Pyridinecarboxylic acids and derivatives 2-halopyridines Aryl chlorides Vinylogous halides Thiosemicarbazides Pyrazolidines Heteroaromatic compounds Carboxylic acid esters Carboxylic acid hydrazides Azacyclic compounds Monocarboxylic acids and derivatives Organic oxides Organochlorides Organosulfur compounds Carbonyl compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Beta amino acid or derivatives - Pyridine carboxylic acid or derivatives - 2-halopyridine - Aryl chloride - Aryl halide - Pyridine - Pyrazolidine - Heteroaromatic compound - Vinylogous halide - Thiosemicarbazide - Carboxylic acid ester - Carboxylic acid hydrazide - Monocarboxylic acid or derivatives - Azacycle - Organoheterocyclic compound - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organic nitrogen compound - Carbonyl group - Organic oxide - Organic oxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as beta amino acids and derivatives. These are amino acids having a (-NH2) group attached to the beta carbon atom.
External Descriptors
Not available