Compound Identification
SMILES
C[C@H](NC(=O)C1=CN=C2N(C(=O)[C@@](C)(CC3=CC=C(C=C3)C#N)N12)C1=CC(Cl)=C(F)C(Cl)=C1)C(=O)N[C@H](C)C1=NC=C(C=C1)C1=CN=C(CO)C=C1
InChIKey
InChIKey=ZEDFQIKEDCCFKO-NLADZYEQSA-N
Formula
C37H31Cl2FN8O4
Mass
741.61
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 Bipyridines and oligopyridines Alanine and derivatives Amphetamines and derivatives 2-heteroaryl carboxamides Benzonitriles Dichlorobenzenes Carbonylimidazoles Fluorobenzenes Aryl chlorides Aryl fluorides N-substituted imidazoles Tertiary carboxylic acid amides Heteroaromatic compounds Secondary carboxylic acid amides Tertiary amines Lactams Nitriles Azacyclic compounds Organic oxides Carbonyl compounds Organochlorides Organofluorides Aromatic alcohols Primary alcohols Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Bipyridine - Alanine or derivatives - Amphetamine or derivatives - Benzonitrile - 1,3-dichlorobenzene - 2-heteroaryl carboxamide - Imidazole-4-carbonyl group - Chlorobenzene - Fluorobenzene - Halobenzene - Aryl fluoride - N-substituted imidazole - Aryl halide - Monocyclic benzene moiety - Benzenoid - Pyridine - Aryl chloride - Azole - Heteroaromatic compound - Tertiary carboxylic acid amide - Imidazole - Lactam - Carboxamide group - Secondary carboxylic acid amide - Tertiary amine - Carbonitrile - Nitrile - Azacycle - Organoheterocyclic compound - Organofluoride - Amine - Primary alcohol - Aromatic alcohol - Carbonyl group - Organic oxygen compound - Organooxygen compound - Organic nitrogen compound - Alcohol - Hydrocarbon derivative - Organic oxide - Cyanide - Organonitrogen compound - Organohalogen compound - Organochloride - 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