Structure Information
Structure

Compound Identification

SMILES

CC(N(CC1=CN=C(C)N=C1N)C=O)=C(CCOP(O)(O)=O)SC(=O)C1=CC=CC=C1

InChIKey

InChIKey=BTNNPSLJPBRMLZ-UHFFFAOYSA-N

Formula

C19H23N4O6PS

Mass

466.45

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Benzoic acids and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Benzoic acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Benzoic acid or derivatives - Thiobenzoic acid or derivatives - Benzoyl - Aminopyrimidine - Monoalkyl phosphate - Organic phosphoric acid derivative - Phosphoric acid ester - Pyrimidine - Alkyl phosphate - Imidolactam - Heteroaromatic compound - Tertiary carboxylic acid amide - Thiocarboxylic acid ester - Amino acid or derivatives - Carbothioic s-ester - Carboxamide group - Sulfenyl compound - Azacycle - Thiocarboxylic acid or derivatives - Organoheterocyclic compound - Carboxylic acid derivative - Amine - Organooxygen compound - Organonitrogen compound - Organic oxide - Organosulfur compound - Hydrocarbon derivative - Carbonyl group - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Primary amine - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as benzoic acids and derivatives. These are organic compounds containing a carboxylic acid substituent attached to a benzene ring.

External Descriptors

CHEBI:41039 : thioester - aminopyrimidine - formamides - organic phosphate

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