Compound Identification
SMILES
BrC1=CC2=C(S1)C=C(N2)C(=O)N[C@H]1COC2=C(NC1=O)C=NC=C2
InChIKey
InChIKey=PDHQFIIEUYDFAH-JTQLQIEISA-N
Formula
C15H11BrN4O3S
Mass
407.24
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
Thienopyrroles Pyrrole carboxamides 2,3,5-trisubstituted thiophenes 2-heteroaryl carboxamides Alkyl aryl ethers Substituted pyrroles Pyridines and derivatives Aryl bromides Heteroaromatic compounds Secondary carboxylic acid amides Lactams Oxacyclic compounds Azacyclic compounds Organonitrogen compounds Organic oxides Organobromides Carbonyl compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-acyl-alpha amino acid or derivatives - 2-heteroaryl carboxamide - Pyrrole-2-carboxamide - Pyrrole-2-carboxylic acid or derivatives - 2,3,5-trisubstituted thiophene - Thienopyrrole - Alkyl aryl ether - Aryl bromide - Aryl halide - Pyridine - Substituted pyrrole - Heteroaromatic compound - Thiophene - Pyrrole - Carboxamide group - Lactam - Secondary carboxylic acid amide - Oxacycle - Ether - Azacycle - Organoheterocyclic compound - Organooxygen compound - Organonitrogen compound - Organobromide - Organohalogen compound - Hydrocarbon derivative - Organic nitrogen compound - Carbonyl group - Organic oxide - Organic oxygen compound - 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