Compound Identification
SMILES
CC1=C(CCOP(O)(=O)OP(O)(O)=O)SC(=S)N1CC1=CN=C(C)N=C1N
InChIKey
InChIKey=SYRCOKXTJAASDE-UHFFFAOYSA-N
Formula
C12H18N4O7P2S2
Mass
456.36
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
-
Class
Organic oxoanionic compounds
- Subclass Organic pyrophosphates
-
Class
Organic oxoanionic compounds
-
Superclass
Organic oxygen compounds
Kingdom
Organic compounds
Superclass
Organic oxygen compounds
Class
Organic oxoanionic compounds
Subclass
Organic pyrophosphates
Intermediate Tree Nodes
Not available
Direct Parent
Organic pyrophosphates
Alternative Parents
Monoalkyl phosphates Aminopyrimidines and derivatives Imidolactams Thiazoles Heteroaromatic compounds Azacyclic compounds Primary amines Organosulfur compounds Organopnictogen compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Organic pyrophosphate - Aminopyrimidine - Monoalkyl phosphate - Organic phosphoric acid derivative - Phosphoric acid ester - Pyrimidine - Alkyl phosphate - Imidolactam - Azole - Thiazole - Heteroaromatic compound - Organoheterocyclic compound - Azacycle - Organic oxide - Primary amine - Organic nitrogen compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organopnictogen compound - Amine - Hydrocarbon derivative - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as organic pyrophosphates. These are organic compounds containing the pyrophosphate oxoanion, with the structure OP([O-])(=O)OP(O)([O-])=O.
External Descriptors
Not available