Compound Identification
SMILES
COC1=CC(=O)N2CN(CNC2S1)N1CCN(C)CC1
InChIKey
InChIKey=SFNUYGXOUOIZTA-UHFFFAOYSA-N
Formula
C12H21N5O2S
Mass
299.39
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Diazinanes
-
Subclass
Piperazines
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Level 5
N-alkylpiperazines
- Level 6 N-methylpiperazines
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Level 5
N-alkylpiperazines
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Subclass
Piperazines
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Class
Diazinanes
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazinanes
Subclass
Piperazines
Intermediate Tree Nodes
N-alkylpiperazines
Direct Parent
N-methylpiperazines
Alternative Parents
Vinylogous thioesters 1,3,5-triazinanes 1,3-thiazines Vinylogous esters Tertiary carboxylic acid amides Monothioacetals Acrylic acids and derivatives Trialkylamines Lactams Amino acids and derivatives Ketene acetals Azacyclic compounds Alkylhydrazines Organic oxides Carbonyl compounds Hydrocarbon derivatives
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
N-methylpiperazine - 1,3,5-triazinane - Meta-thiazine - Vinylogous thioester - Triazinane - Acrylic acid or derivatives - Vinylogous ester - Tertiary carboxylic acid amide - Monothioacetal - Amino acid or derivatives - Carboxamide group - Ketene acetal or derivatives - Lactam - Tertiary aliphatic amine - Tertiary amine - Alkylhydrazine - Carboxylic acid derivative - Azacycle - Hydrocarbon derivative - Hydrazine derivative - Organic oxygen compound - Organic oxide - Carbonyl group - Organic nitrogen compound - Amine - Organooxygen compound - Organonitrogen compound - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as n-methylpiperazines. These are organic compounds containing a piperazine ring where the nitrogen ring atom carries a methyl group.
External Descriptors
Not available