Compound Identification
SMILES
CC1=CC(=NN1)N1C[C@@H](C[C@H]1C(=O)NC1(CC1)C#N)[S@](=O)C1=CC=CC=C1C(F)(F)F
InChIKey
InChIKey=GTBFKRCCQBZRAL-UGNZZKKFSA-N
Formula
C20H20F3N5O2S
Mass
451.47
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Organic acids and derivatives
-
Class
Carboxylic acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
-
Level 5
Amino acids and derivatives
-
Level 6
Alpha amino acids and derivatives
- Level 7 Proline 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
Proline and derivatives
Alternative Parents
Alpha amino acid amides Trifluoromethylbenzenes Phenyl sulfoxides Dialkylarylamines Pyrrolidinecarboxamides Imidolactams Pyrazoles Heteroaromatic compounds Sulfoxides Secondary carboxylic acid amides Sulfinyl compounds Nitriles Azacyclic compounds Organofluorides Organic oxides Hydrocarbon derivatives Alkyl fluorides Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Proline or derivatives - Alpha-amino acid amide - Trifluoromethylbenzene - Phenyl sulfoxide - Pyrrolidine-2-carboxamide - Dialkylarylamine - Pyrrolidine carboxylic acid or derivatives - Benzenoid - Imidolactam - Monocyclic benzene moiety - Pyrrolidine - Azole - Heteroaromatic compound - Pyrazole - Sulfoxide - Secondary carboxylic acid amide - Carboxamide group - Carbonitrile - Nitrile - Azacycle - Organoheterocyclic compound - Sulfinyl compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Alkyl halide - Alkyl fluoride - Organic oxide - Carbonyl group - Cyanide - Organic oxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic nitrogen compound - Amine - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as proline and derivatives. These are compounds containing proline or a derivative thereof resulting from reaction of proline at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
External Descriptors
Not available