Compound Identification
SMILES
CC(C)(C)OC(=O)C1=C(CBr)C(Br)S[C@H]2C(NC(=O)C3=CC=CC=C3)C(=O)N12
InChIKey
InChIKey=LEIVPXUCEUEDEB-AJUCZRQESA-N
Formula
C19H20Br2N2O4S
Mass
532.25
Taxonomic Classification
Taxonomy Tree
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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
Benzamides Cephems Benzoyl derivatives 1,3-thiazines Tertiary carboxylic acid amides Enoate esters Secondary carboxylic acid amides Tertiary amines Azetidines Monocarboxylic acids and derivatives Dialkylthioethers Thiohemiaminal derivatives Azacyclic compounds Hydrocarbon derivatives Alkyl bromides Carbonyl compounds Organic oxides Organobromides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-acyl-alpha amino acid or derivatives - Benzamide - Benzoic acid or derivatives - Cephem - Benzoyl - Meta-thiazine - Monocyclic benzene moiety - Benzenoid - Beta-lactam - Tertiary carboxylic acid amide - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Tertiary amine - Secondary carboxylic acid amide - Azetidine - Carboxamide group - Lactam - Carboxylic acid ester - Hemithioaminal - Thioether - Azacycle - Dialkylthioether - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Amine - Organohalogen compound - Carbonyl group - Organic nitrogen compound - Organobromide - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Alkyl bromide - Alkyl halide - Aromatic heteropolycyclic 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