Compound Identification
SMILES
C[C@H](N1C(=O)C2CC=CCC2C1=O)C(=O)NC1=NN=C(SCC2=CC=C(Cl)C=C2)S1
InChIKey
InChIKey=IEHCLEQJDMHASW-QGLTVNCISA-N
Formula
C20H19ClN4O3S2
Mass
462.97
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organic acids and derivatives
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Class
Carboxylic acids and derivatives
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Subclass
Amino acids, peptides, and analogues
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Level 5
Amino acids and derivatives
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Level 6
Alpha amino acids and derivatives
- Level 7 Alanine and derivatives
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Level 6
Alpha amino acids and derivatives
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Level 5
Amino acids and derivatives
-
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
Alanine and derivatives
Alternative Parents
Isoindolones Isoindoles N-arylamides Alkylarylthioethers Chlorobenzenes Aryl chlorides Pyrrolidine-2-ones N-substituted carboxylic acid imides N-alkylpyrrolidines Thiadiazoles Dicarboximides Heteroaromatic compounds Secondary carboxylic acid amides Lactams Azacyclic compounds Sulfenyl compounds Organic oxides Organochlorides Carbonyl compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alanine or derivatives - Isoindolone - Isoindoline - Isoindole - Isoindole or derivatives - Aryl thioether - N-arylamide - Chlorobenzene - Halobenzene - Alkylarylthioether - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Carboxylic acid imide, n-substituted - Pyrrolidone - 2-pyrrolidone - N-alkylpyrrolidine - Benzenoid - Carboxylic acid imide - Pyrrolidine - Thiadiazole - Azole - Heteroaromatic compound - Dicarboximide - Carboxamide group - Lactam - Secondary carboxylic acid amide - Organoheterocyclic compound - Sulfenyl compound - Thioether - Azacycle - Organosulfur compound - Organic oxygen compound - Organic oxide - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as alanine and derivatives. These are compounds containing alanine or a derivative thereof resulting from reaction of alanine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
External Descriptors
Not available