Compound Identification
SMILES
OC(=O)CN1C(=S)SC(=CC2=CC(Cl)=CC(Br)=C2O)C1=O
InChIKey
InChIKey=CJGNXYFCXBEPDQ-UHFFFAOYSA-N
Formula
C12H7BrClNO4S2
Mass
408.67
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
-
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
P-chlorophenols O-bromophenols Bromobenzenes Chlorobenzenes Thiazolidinethiones Aryl bromides Aryl chlorides Cyclic dithiocarbamic acid esters Azacyclic compounds Carboxylic acids Monocarboxylic acids and derivatives Hydrocarbon derivatives Organic oxides Carbonyl compounds Organobromides Organochlorides Organonitrogen compounds Organosulfur compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alpha-amino acid or derivatives - 2-bromophenol - 2-halophenol - 4-halophenol - 4-chlorophenol - Halobenzene - Chlorobenzene - Bromobenzene - Phenol - Aryl bromide - Aryl chloride - Aryl halide - Thiazolidinethione - Benzenoid - Monocyclic benzene moiety - Cyclic dithiocarbamic acid ester - Thiazolidine - Dithiocarbamic acid ester - Azacycle - Organoheterocyclic compound - Carboxylic acid - Monocarboxylic acid or derivatives - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organochloride - Organic oxide - Organobromide - Organohalogen 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