Compound Identification
SMILES
CC1=CC=C(CN2CC[C@H](C2)NC(=O)CNC(=O)C2=CC3=C(S2)C=CC(F)=C3)C=C1
InChIKey
InChIKey=PZVPWLBJLOCHEJ-LJQANCHMSA-N
Formula
C23H24FN3O2S
Mass
425.52
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
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Class
Carboxylic acids and derivatives
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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
Alpha amino acid amides 1-benzothiophenes Thiophene carboxamides 2,3,5-trisubstituted thiophenes Phenylmethylamines 2-heteroaryl carboxamides Benzylamines Toluenes Aralkylamines Aryl fluorides N-alkylpyrrolidines Heteroaromatic compounds Secondary carboxylic acid amides Trialkylamines Azacyclic compounds Carbonyl compounds Organic oxides Organofluorides Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Benzothiophene - 1-benzothiophene - 2-heteroaryl carboxamide - Benzylamine - Phenylmethylamine - Thiophene carboxamide - Thiophene carboxylic acid or derivatives - 2,3,5-trisubstituted thiophene - Toluene - Aralkylamine - N-alkylpyrrolidine - Benzenoid - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Thiophene - Heteroaromatic compound - Pyrrolidine - Tertiary aliphatic amine - Tertiary amine - Secondary carboxylic acid amide - Carboxamide group - Organoheterocyclic compound - Azacycle - Amine - Organohalogen compound - Organic oxide - Organofluoride - Carbonyl group - Organopnictogen compound - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic nitrogen compound - 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