Compound Identification
SMILES
BrC1=CC(=CNNC(=O)CNC(=O)C2=CC=CS2)C(=O)C(Br)=C1
InChIKey
InChIKey=VKJMOQPUMFKSRS-UHFFFAOYSA-N
Formula
C14H11Br2N3O3S
Mass
461.13
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 - Alpha amino acids and derivatives
Direct Parent
N-acyl-alpha amino acids and derivatives
Alternative Parents
Thiophene carboxamides O-quinomethanes 2-heteroaryl carboxamides Vinylogous amides Heteroaromatic compounds Alpha-haloketones Secondary carboxylic acid amides Carboxylic acid hydrazides Vinyl bromides Bromoalkenes Organonitrogen compounds Organobromides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-acyl-alpha amino acid or derivatives - 2-heteroaryl carboxamide - O-quinomethane - Quinomethane - Thiophene carboxamide - Thiophene carboxylic acid or derivatives - Alpha-haloketone - Heteroaromatic compound - Vinylogous amide - Thiophene - Carboxamide group - Carboxylic acid hydrazide - Ketone - Secondary carboxylic acid amide - Cyclic ketone - Bromoalkene - Haloalkene - Organoheterocyclic compound - Vinyl halide - Vinyl bromide - Organonitrogen compound - Organobromide - Organohalogen compound - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as n-acyl-alpha amino acids and derivatives. These are compounds containing an alpha amino acid (or a derivative thereof) which bears an acyl group at its terminal nitrogen atom.
External Descriptors
Not available