Compound Identification
SMILES
CNC.OC(=O)CN1C(=S)S\C(=C\C2=CC=C(C=C2)N(CCCl)CCCl)C1=O
InChIKey
InChIKey=UQOZMSYLQGERML-KJEVSKRMSA-N
Formula
C18H23Cl2N3O3S2
Mass
464.42
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Carboxylic acids and derivatives
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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
Direct Parent
Alpha amino acids and derivatives
Alternative Parents
Aniline and substituted anilines Nitrogen mustard compounds Dialkylarylamines Thiazolidinethiones Cyclic dithiocarbamic acid esters Amino acids Azacyclic compounds Monocarboxylic acids and derivatives Carboxylic acids Dialkylamines Hydrocarbon derivatives Carbonyl compounds Organic oxides Organochlorides Organosulfur compounds Alkyl chlorides
Molecular Framework
Not available
Substituents
Alpha-amino acid or derivatives - Nitrogen mustard - Tertiary aliphatic/aromatic amine - Aniline or substituted anilines - Dialkylarylamine - Monocyclic benzene moiety - Benzenoid - Thiazolidinethione - Cyclic dithiocarbamic acid ester - Dithiocarbamic acid ester - Thiazolidine - Amino acid - Tertiary amine - Carboxylic acid - Secondary aliphatic amine - Monocarboxylic acid or derivatives - Secondary amine - Azacycle - Organoheterocyclic compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organic oxide - Organic nitrogen compound - Alkyl halide - Alkyl chloride - Carbonyl group - Organooxygen compound - Organosulfur compound - Amine - Hydrocarbon derivative - Organic oxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as alpha amino acids and derivatives. These are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon), or a derivative thereof.
External Descriptors
Not available