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Details

Stereochemistry MIXED
Molecular Formula C15H22N2O5S
Molecular Weight 342.411
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Methyl 1-methoxy-4-[4-methyl-6-(methylsulfonyl)-2-pyrimidinyl]cyclohexanecarboxylate

SMILES

COC(=O)C1(CCC(CC1)C2=NC(=CC(C)=N2)S(C)(=O)=O)OC

InChI

InChIKey=NFRQLSIMKLQLRK-UHFFFAOYSA-N
InChI=1S/C15H22N2O5S/c1-10-9-12(23(4,19)20)17-13(16-10)11-5-7-15(22-3,8-6-11)14(18)21-2/h9,11H,5-8H2,1-4H3

HIDE SMILES / InChI

Molecular Formula C15H22N2O5S
Molecular Weight 342.411
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 21:00:17 GMT 2025
Edited
by admin
on Wed Apr 02 21:00:17 GMT 2025
Record UNII
3AXS3A57PG
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Methyl 1-methoxy-4-[4-methyl-6-(methylsulfonyl)-2-pyrimidinyl]cyclohexanecarboxylate
Systematic Name English
Cyclohexanecarboxylic acid, 1-methoxy-4-[4-methyl-6-(methylsulfonyl)-2-pyrimidinyl]-, methyl ester
Preferred Name English
Code System Code Type Description
PUBCHEM
129073628
Created by admin on Wed Apr 02 21:00:17 GMT 2025 , Edited by admin on Wed Apr 02 21:00:17 GMT 2025
PRIMARY
CAS
2097133-29-2
Created by admin on Wed Apr 02 21:00:17 GMT 2025 , Edited by admin on Wed Apr 02 21:00:17 GMT 2025
PRIMARY
FDA UNII
3AXS3A57PG
Created by admin on Wed Apr 02 21:00:17 GMT 2025 , Edited by admin on Wed Apr 02 21:00:17 GMT 2025
PRIMARY