Compound Identification
SMILES
BrC1=CC2=C(NC(=O)[C@@]22SC[C@@H]3N2C(=O)[C@@H]2CCCN2C3=O)C=C1
InChIKey
InChIKey=NQZYFTWRYIQMBL-MKBNYLNASA-N
Formula
C16H14BrN3O3S
Mass
408.27
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
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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
Indolines 2,5-dioxopiperazines N-alkylpiperazines Aryl bromides Benzenoids Thiazolidines Tertiary carboxylic acid amides Pyrrolidines Tertiary amines Secondary carboxylic acid amides Lactams Dialkylthioethers Azacyclic compounds Carbonyl compounds Organobromides Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid or derivatives - Indole or derivatives - Dihydroindole - Dioxopiperazine - 2,5-dioxopiperazine - N-alkylpiperazine - Aryl bromide - Aryl halide - 1,4-diazinane - Piperazine - Benzenoid - Thiazolidine - Tertiary carboxylic acid amide - Pyrrolidine - Tertiary amine - Secondary carboxylic acid amide - Carboxamide group - Lactam - Dialkylthioether - Organoheterocyclic compound - Azacycle - Thioether - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organohalogen compound - Carbonyl group - Organobromide - Organonitrogen compound - Amine - Organooxygen compound - Aromatic heteropolycyclic 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