Compound Identification
SMILES
CCOC1=CC=C(NC2=NC(=O)C(NNC(N)=S)=C\C2=N/C2=CC=C(OCC)C=C2)C=C1
InChIKey
InChIKey=OPPKONKMOVNASM-HKOYGPOVSA-N
Formula
C22H24N6O3S
Mass
452.53
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
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
Direct Parent
Alpha amino acids and derivatives
Alternative Parents
Phenoxy compounds Phenol ethers Aniline and substituted anilines Alkyl aryl ethers Dihydropyridines Thiosemicarbazides Secondary ketimines Azomethines N-acylimines Carboxamidines Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Hydrocarbon derivatives Organic oxides Carbonyl compounds Organopnictogen compounds Organosulfur compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alpha-amino acid or derivatives - Phenol ether - Aniline or substituted anilines - Phenoxy compound - Dihydropyridine - Alkyl aryl ether - Monocyclic benzene moiety - Hydropyridine - Benzenoid - Azomethine - Secondary ketimine - Thiosemicarbazide - Ketimine - N-acylimine - Amidine - Carboxylic acid amidine - Azacycle - Ether - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organic nitrogen compound - Organopnictogen compound - Organic oxygen compound - Imine - Organic oxide - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Carbonyl group - Aromatic heteromonocyclic 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