Compound Identification
SMILES
C\C=C/C(=C(/Cl)C=C)/C1=NC(=CN=C1C1=CC=C(C=C1)C(F)(F)F)N1CCC(CC1)NC(=O)[C@@H]1CCCN1
InChIKey
InChIKey=BUMVTQADQMWSPT-BLUCWYIJSA-N
Formula
C28H31ClF3N5O
Mass
546.04
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 Pyrrolidinecarboxamides Dialkylarylamines Aminopyrazines Piperidines Imidolactams Heteroaromatic compounds Secondary carboxylic acid amides Vinyl chlorides Azacyclic compounds Chloroalkenes Dialkylamines Hydrocarbon derivatives Carbonyl compounds Organic oxides Organochlorides Organofluorides Alkyl fluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Proline or derivatives - Alpha-amino acid amide - Trifluoromethylbenzene - Pyrrolidine carboxylic acid or derivatives - Dialkylarylamine - Pyrrolidine-2-carboxamide - Aminopyrazine - Monocyclic benzene moiety - Piperidine - Pyrazine - Imidolactam - Benzenoid - Heteroaromatic compound - Pyrrolidine - Carboxamide group - Secondary carboxylic acid amide - Secondary aliphatic amine - Azacycle - Chloroalkene - Haloalkene - Organoheterocyclic compound - Vinyl halide - Secondary amine - Vinyl chloride - Organonitrogen compound - Organofluoride - Organochloride - Organohalogen compound - Alkyl fluoride - Hydrocarbon derivative - Organooxygen compound - Alkyl halide - Organic nitrogen compound - Amine - Organic oxygen compound - Organic oxide - Carbonyl group - 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