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Details

Stereochemistry ACHIRAL
Molecular Formula C9H14N2O2S.ClH
Molecular Weight 250.746
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-((4,6,6-TRIMETHYL-1,6-DIHYDROPYRIMIDIN-2-YL)THIO)ACETIC ACID HYDROCHLORIDE

SMILES

Cl.CC1=CC(C)(C)NC(SCC(O)=O)=N1

InChI

InChIKey=PVVCRAHNTGHTEA-UHFFFAOYSA-N
InChI=1S/C9H14N2O2S.ClH/c1-6-4-9(2,3)11-8(10-6)14-5-7(12)13;/h4H,5H2,1-3H3,(H,10,11)(H,12,13);1H

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
2-((4,6,6-TRIMETHYL-1,6-DIHYDROPYRIMIDIN-2-YL)THIO)ACETIC ACID HYDROCHLORIDE
Systematic Name English
ACETIC ACID, ((1,4-DIHYDRO-4,4,6-TRIMETHYL-2-PYRIMIDINYL)THIO)-, MONOHYDROCHLORIDE
Preferred Name English
ACETIC ACID, 2-((1,6-DIHYDRO-4,6,6-TRIMETHYL-2-PYRIMIDINYL)THIO)-, HYDROCHLORIDE (1:1)
Systematic Name English
Code System Code Type Description
FDA UNII
R1BKG0NNAN
Created by admin on Mon Mar 31 22:32:58 GMT 2025 , Edited by admin on Mon Mar 31 22:32:58 GMT 2025
PRIMARY
PUBCHEM
85788487
Created by admin on Mon Mar 31 22:32:58 GMT 2025 , Edited by admin on Mon Mar 31 22:32:58 GMT 2025
PRIMARY
CAS
34928-00-2
Created by admin on Mon Mar 31 22:32:58 GMT 2025 , Edited by admin on Mon Mar 31 22:32:58 GMT 2025
PRIMARY
NIH
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