Compound Identification
SMILES
CC1(C)CC2=C(C(=O)C1)C(NC(=O)C1=CC=CS1)(C(=O)N2CC1=CC=CO1)C(F)(F)F
InChIKey
InChIKey=ZVBNXTXGJOEEJZ-UHFFFAOYSA-N
Formula
C21H19F3N2O4S
Mass
452.45
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Carboxylic acids and derivatives
-
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
Indoles and derivatives 2-heteroaryl carboxamides Thiophene carboxamides Cyclohexenones Vinylogous amides Tertiary carboxylic acid amides Furans Heteroaromatic compounds Pyrrolines Lactams Secondary carboxylic acid amides Oxacyclic compounds Azacyclic compounds Hydrocarbon derivatives Alkyl fluorides Organic oxides Organofluorides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-acyl-alpha amino acid or derivatives - Indole or derivatives - 2-heteroaryl carboxamide - Thiophene carboxamide - Thiophene carboxylic acid or derivatives - Cyclohexenone - Furan - Pyrroline - Heteroaromatic compound - Tertiary carboxylic acid amide - Vinylogous amide - Thiophene - Carboxamide group - Ketone - Lactam - Secondary carboxylic acid amide - Oxacycle - Azacycle - Organoheterocyclic compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Organic oxide - Alkyl halide - Organic oxygen compound - Organic nitrogen compound - Alkyl fluoride - Carbonyl group - Aromatic heteropolycyclic 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