Compound Identification
SMILES
CC1=NC=C(CNC(=O)N(CCCl)N=O)C(N)=N1.CCOP(=O)(OCC)C(C)N(CCCl)C(=O)NN=O
InChIKey
InChIKey=IIIRSYLPVXFGFI-UHFFFAOYSA-N
Formula
C18H32Cl2N9O7P
Mass
588.38
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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Class
Diazines
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Subclass
Pyrimidines and pyrimidine derivatives
- Level 5 Aminopyrimidines and derivatives
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Subclass
Pyrimidines and pyrimidine derivatives
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Class
Diazines
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazines
Subclass
Pyrimidines and pyrimidine derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Aminopyrimidines and derivatives
Alternative Parents
Dialkyl alkylphosphonates Phosphonic acid esters Nitrosoureas Imidolactams Semicarbazides Nitrosamides Heteroaromatic compounds Azacyclic compounds Primary amines Organophosphorus compounds Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl chlorides
Molecular Framework
Not available
Substituents
Aminopyrimidine - Dialkyl alkylphosphonate - Phosphonic acid diester - Nitrosourea - Phosphonic acid ester - Imidolactam - Organophosphonic acid derivative - Heteroaromatic compound - Nitrosamide - Semicarbazide - Organic n-nitroso compound - Organic nitroso compound - Azacycle - Alkyl chloride - Primary amine - Hydrocarbon derivative - Organophosphorus compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organic oxide - Organohalogen compound - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Amine - Alkyl halide - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as aminopyrimidines and derivatives. These are organic compounds containing an amino group attached to a pyrimidine ring. Pyrimidine is a 6-membered ring consisting of four carbon atoms and two nitrogen centers at the 1- and 3- ring positions.
External Descriptors
Not available