Compound Identification
SMILES
COC1=NC2=C(C=CC=C2OCC2=C(Cl)C=CC(N(C)C(=O)CNC(=O)CCC3=CN=C(NC(=O)CN)C=C3)=C2Cl)N1CC1=CC=CC=N1
InChIKey
InChIKey=QAZKQRBGBSZJFE-UHFFFAOYSA-N
Formula
C34H34Cl2N8O5
Mass
705.6
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
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Class
Carboxylic acids and derivatives
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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 Anilides Benzimidazoles Phenol ethers Dichlorobenzenes N-arylamides Alkyl aryl ethers Aryl chlorides Pyridines and derivatives Fatty amides Imidolactams N-substituted imidazoles Heteroaromatic compounds Tertiary carboxylic acid amides Secondary carboxylic acid amides Tertiary amines Azacyclic compounds Organochlorides Carbonyl compounds Hydrocarbon derivatives Monoalkylamines Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Benzimidazole - Anilide - Phenol ether - 1,3-dichlorobenzene - N-arylamide - Chlorobenzene - Alkyl aryl ether - Halobenzene - Fatty acyl - Monocyclic benzene moiety - Imidolactam - Benzenoid - Aryl chloride - Pyridine - N-substituted imidazole - Fatty amide - Aryl halide - Imidazole - Tertiary carboxylic acid amide - Azole - Heteroaromatic compound - Tertiary amine - Carboxamide group - Secondary carboxylic acid amide - Ether - Organoheterocyclic compound - Azacycle - Organonitrogen compound - Organooxygen compound - Primary amine - Amine - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organochloride - Primary aliphatic amine - Organohalogen 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