Compound Identification
SMILES
OC(=O)C(F)(F)F.CSC1=NC=CC(=N1)C1=CC=C(S1)S(=O)(=O)NC1CCN(CC2=CC=CC(=C2)C(N)=N)C1=O
InChIKey
InChIKey=RLRJMDSPLJIIRG-UHFFFAOYSA-N
Formula
C23H23F3N6O5S3
Mass
616.65
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
Direct Parent
Alpha amino acids and derivatives
Alternative Parents
2,5-disubstituted thiophenes Alkylarylthioethers Pyrrolidine-2-ones Pyrimidines and pyrimidine derivatives Organosulfonamides N-alkylpyrrolidines Benzene and substituted derivatives Tertiary carboxylic acid amides Alpha-halocarboxylic acids Aminosulfonyl compounds Heteroaromatic compounds Lactams Sulfenyl compounds Monocarboxylic acids and derivatives Azacyclic compounds Carboxamidines Carboximidamides Carboxylic acids Hydrocarbon derivatives Carbonyl compounds Organic oxides Alkyl fluorides Organofluorides
Molecular Framework
Not available
Substituents
Alpha-amino acid or derivatives - Aryl thioether - 2,5-disubstituted thiophene - Alkylarylthioether - Monocyclic benzene moiety - Pyrimidine - Pyrrolidone - 2-pyrrolidone - Organosulfonic acid amide - N-alkylpyrrolidine - Benzenoid - Pyrrolidine - Aminosulfonyl compound - Thiophene - Heteroaromatic compound - Tertiary carboxylic acid amide - Sulfonyl - Alpha-halocarboxylic acid or derivatives - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Alpha-halocarboxylic acid - Lactam - Carboxamide group - Thioether - Carboximidamide - Azacycle - Organoheterocyclic compound - Carboxylic acid amidine - Sulfenyl compound - Carboxylic acid - Amidine - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Carbonyl group - Alkyl fluoride - Organic oxygen compound - Organic oxide - Organosulfur compound - Alkyl halide - Organic nitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as alpha amino acids and derivatives. These are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon), or a derivative thereof.
External Descriptors
Not available