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Details

Stereochemistry ACHIRAL
Molecular Formula C19H21FN4O6
Molecular Weight 420.3916
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Methyl 2-[[1-[4-[[[(4-fluorophenyl)methyl]amino]carbonyl]-1,6-dihydro-5-hydroxy-1-methyl-6-oxo-2-pyrimidinyl]-1-methylethyl]amino]-2-oxoacetate

SMILES

COC(=O)C(=O)NC(C)(C)C1=NC(C(=O)NCC2=CC=C(F)C=C2)=C(O)C(=O)N1C

InChI

InChIKey=INYVTIRVESMVAC-UHFFFAOYSA-N
InChI=1S/C19H21FN4O6/c1-19(2,23-15(27)17(29)30-4)18-22-12(13(25)16(28)24(18)3)14(26)21-9-10-5-7-11(20)8-6-10/h5-8,25H,9H2,1-4H3,(H,21,26)(H,23,27)

HIDE SMILES / InChI

Molecular Formula C19H21FN4O6
Molecular Weight 420.3916
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 15:07:22 GMT 2025
Edited
by admin
on Wed Apr 02 15:07:22 GMT 2025
Record UNII
Q6L4J3B2SC
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Methyl 2-[[1-[4-[[[(4-fluorophenyl)methyl]amino]carbonyl]-1,6-dihydro-5-hydroxy-1-methyl-6-oxo-2-pyrimidinyl]-1-methylethyl]amino]-2-oxoacetate
Systematic Name English
Acetic acid, 2-[[1-[4-[[[(4-fluorophenyl)methyl]amino]carbonyl]-1,6-dihydro-5-hydroxy-1-methyl-6-oxo-2-pyrimidinyl]-1-methylethyl]amino]-2-oxo-, methyl ester
Preferred Name English
Acetic acid, [[1-[4-[[[(4-fluorophenyl)methyl]amino]carbonyl]-1,6-dihydro-5-hydroxy-1-methyl-6-oxo-2-pyrimidinyl]-1-methylethyl]amino]oxo-, methyl ester (
Systematic Name English
Methyl [[1-[4-[[(4-fluorobenzyl)amino]carbonyl]-5-hydroxy-1-methyl-6-oxo-1,6-dihydropyrimidin-2-yl]-1-methylethyl]amino](oxo)acetate
Systematic Name English
Code System Code Type Description
FDA UNII
Q6L4J3B2SC
Created by admin on Wed Apr 02 15:07:22 GMT 2025 , Edited by admin on Wed Apr 02 15:07:22 GMT 2025
PRIMARY
CAS
518048-04-9
Created by admin on Wed Apr 02 15:07:22 GMT 2025 , Edited by admin on Wed Apr 02 15:07:22 GMT 2025
PRIMARY
EPA CompTox
DTXSID801100843
Created by admin on Wed Apr 02 15:07:22 GMT 2025 , Edited by admin on Wed Apr 02 15:07:22 GMT 2025
PRIMARY
PUBCHEM
54737243
Created by admin on Wed Apr 02 15:07:22 GMT 2025 , Edited by admin on Wed Apr 02 15:07:22 GMT 2025
PRIMARY