Structure Information
Structure

Compound Identification

SMILES

CC1=C(CC=O)SC=[N+]1CC1=CN=C(C)N=C1N

InChIKey

InChIKey=YLTKXCQXTWMOIT-UHFFFAOYSA-N

Formula

C12H15N4OS

Mass

263.34

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Taxonomic Classification

Taxonomy Tree

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

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

4,5-disubstituted 1,3-thiazole - Aminopyrimidine - Imidolactam - Alpha-hydrogen aldehyde - Azole - Thiazole - Heteroaromatic compound - Azacycle - Organic nitrogen compound - Aldehyde - Hydrocarbon derivative - Primary amine - Organooxygen compound - Organonitrogen compound - Carbonyl group - Organic oxide - Organopnictogen compound - Amine - Organic oxygen compound - Organic cation - 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

CHEBI:27824 : heteroarenecarbaldehyde - thiamine
META CYC (THIAMINE-ALDEHYDE) : a small molecule

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