Compound Identification
SMILES
CC(C)(CO)N[C@@]1(NCC(N)=O)N=C(NC2=C1SC=N2)SCC1=C(F)C(F)=CC=C1
InChIKey
InChIKey=YEYIKMURBSHJRX-SFHVURJKSA-N
Formula
C18H22F2N6O2S2
Mass
456.53
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
-
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
Direct Parent
Alpha amino acids and derivatives
Alternative Parents
Fluorobenzenes Aryl fluorides Imidolactams Thiazoles Heteroaromatic compounds Primary carboxylic acid amides Orthocarboxylic acid derivatives Ortho amides Isothioureas Sulfenyl compounds Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Hydrocarbon derivatives Organic oxides Carbonyl compounds Organofluorides Primary alcohols
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - Halobenzene - Fluorobenzene - Aryl fluoride - Aryl halide - Imidolactam - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Azole - Thiazole - Isothiourea - Carboxamide group - Ortho amide - Orthocarboxylic acid derivative - Primary carboxylic acid amide - Organoheterocyclic compound - Azacycle - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Sulfenyl compound - Alcohol - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organosulfur compound - Primary alcohol - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic 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