Compound Identification
SMILES
ClC1=CC=C(C=C1)N(CC1=CC=CC=C1)C(=S)NNC1=C(Cl)C=C(C=N1)C(=O)NC1CCSC1=O
InChIKey
InChIKey=DZUXJVSILOYDJJ-UHFFFAOYSA-N
Formula
C24H21Cl2N5O2S2
Mass
546.49
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
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
-
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
Nicotinamides Chlorobenzenes Imidolactams Aryl chlorides Thiosemicarbazides Heteroaromatic compounds Carbothioic S-lactones Thiolanes Thiolactones Thioesters Secondary carboxylic acid amides Azacyclic compounds Organosulfur compounds Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-acyl-alpha amino acid or derivatives - Nicotinamide - Pyridinecarboxamide - Pyridine carboxylic acid or derivatives - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Pyridine - Benzenoid - Imidolactam - Carbothioic s-lactone - Thiosemicarbazide - Heteroaromatic compound - Thiolane - Thiolactone - Thiocarboxylic acid ester - Carboxamide group - Secondary carboxylic acid amide - Organoheterocyclic compound - Thiocarboxylic acid or derivatives - Azacycle - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organosulfur compound - Carbonyl group - Organochloride - Organonitrogen compound - Organooxygen compound - 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