Compound Identification
SMILES
O[C@H]1CN(C[C@H]1O)C(=O)[C@H](CC1=CC=CC=C1)NC(=O)C1=C(Cl)C2=C(N1)SC(Cl)=C2
InChIKey
InChIKey=ZDJFSJMKSZOQEU-MELADBBJSA-N
Formula
C20H19Cl2N3O4S
Mass
468.35
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
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Class
Carboxylic acids and derivatives
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Subclass
Amino acids, peptides, and analogues
- Level 5 Amino acids and derivatives
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Subclass
Amino acids, peptides, and analogues
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Class
Carboxylic acids and derivatives
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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
Alpha amino acid amides Amphetamines and derivatives 2,3,5-trisubstituted thiophenes Thienopyrroles 2-heteroaryl carboxamides N-acylpyrrolidines Pyrrole carboxamides Substituted pyrroles Aryl chlorides Heteroaromatic compounds Azoles Vinylogous halides Tertiary carboxylic acid amides Secondary alcohols Secondary carboxylic acid amides 1,2-diols Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Organochlorides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Amphetamine or derivatives - 2-heteroaryl carboxamide - N-acylpyrrolidine - Pyrrole-2-carboxamide - 2,3,5-trisubstituted thiophene - Pyrrole-2-carboxylic acid or derivatives - Thienopyrrole - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Substituted pyrrole - Azole - Heteroaromatic compound - Vinylogous halide - Thiophene - Pyrrole - Pyrrolidine - Tertiary carboxylic acid amide - Secondary carboxylic acid amide - Secondary alcohol - 1,2-diol - Carboxamide group - Organoheterocyclic compound - Azacycle - Hydrocarbon derivative - Organohalogen compound - Carbonyl group - Alcohol - Organochloride - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Organonitrogen compound - Organooxygen 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