Compound Identification
SMILES
CC(C)C(NC(=O)NC1=CC(F)=C(F)C=C1)C(=O)NC1=NN=C(S1)C1=CC=C(C)C=C1
InChIKey
InChIKey=FQHBIOMBAXKCMY-UHFFFAOYSA-N
Formula
C21H21F2N5O2S
Mass
445.49
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- 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-carbamoyl-alpha amino acids and derivatives
Alternative Parents
Valine and derivatives Alpha amino acid amides N-phenylureas N-arylamides Toluenes Fluorobenzenes Aryl fluorides Fatty amides Heteroaromatic compounds Thiadiazoles Secondary carboxylic acid amides Ureas Azacyclic compounds Organopnictogen compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organofluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-carbamoyl-alpha-amino acid or derivatives - Valine or derivatives - Alpha-amino acid amide - N-phenylurea - N-arylamide - Fluorobenzene - Halobenzene - Toluene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Fatty amide - Benzenoid - Fatty acyl - Thiadiazole - Azole - Heteroaromatic compound - Secondary carboxylic acid amide - Urea - Carbonic acid derivative - Carboxamide group - Organoheterocyclic compound - Azacycle - Organic nitrogen compound - Organopnictogen compound - Organic oxygen compound - Organic oxide - Carbonyl group - Hydrocarbon derivative - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as n-carbamoyl-alpha amino acids and derivatives. These are compounds containing an alpha amino acid (or a derivative thereof) which bears an carbamoyl group at its terminal nitrogen atom.
External Descriptors
Not available