Compound Identification
SMILES
COP(=S)(OC)SCN1N=NC2=CC=CC(N)C2C1=O
InChIKey
InChIKey=MWUVDSPBHGCVBY-UHFFFAOYSA-N
Formula
C10H15N4O3PS2
Mass
334.35
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
- Level 6 Beta amino acids and derivatives
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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
Beta amino acids and derivatives
Alternative Parents
Dithiophosphate S-esters Dithiophosphate O-esters 1,2,3-triazines Sulfenyl compounds Propargyl-type 1,3-dipolar organic compounds Organothiophosphorus compounds Azacyclic compounds Organopnictogen compounds Organic oxides Monoalkylamines Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Beta amino acid or derivatives - Triazine - Dithiophosphate s-ester - Dithiophosphate o-ester - 1,2,3-triazine - Organic dithiophosphate - Organothiophosphorus compound - Sulfenyl compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organoheterocyclic compound - Azacycle - Organopnictogen compound - Amine - Organic oxygen compound - Primary amine - Organosulfur compound - Organooxygen compound - Organic oxide - Organic nitrogen compound - Carbonyl group - Primary aliphatic amine - Hydrocarbon derivative - Organonitrogen compound - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as beta amino acids and derivatives. These are amino acids having a (-NH2) group attached to the beta carbon atom.
External Descriptors
Not available