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Details

Stereochemistry ACHIRAL
Molecular Formula C17H19N3O6
Molecular Weight 361.3493
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Methyl 2-(2-(benzyloxycarbonylamino)propan-2-yl)-5-hydroxy-6-oxo-1,6-dihydropyrimidine-4-carboxylate

SMILES

COC(=O)C1=C(O)C(=O)NC(=N1)C(C)(C)NC(=O)OCC2=CC=CC=C2

InChI

InChIKey=NIVUTAZNLHLBAN-UHFFFAOYSA-N
InChI=1S/C17H19N3O6/c1-17(2,20-16(24)26-9-10-7-5-4-6-8-10)15-18-11(14(23)25-3)12(21)13(22)19-15/h4-8,21H,9H2,1-3H3,(H,20,24)(H,18,19,22)

HIDE SMILES / InChI

Molecular Formula C17H19N3O6
Molecular Weight 361.3493
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 19:32:44 GMT 2025
Edited
by admin
on Wed Apr 02 19:32:44 GMT 2025
Record UNII
TD9P5W8AF2
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-Pyrimidinecarboxylic acid, 1,6-dihydro-5-hydroxy-2-[1-methyl-1-[[(phenylmethoxy)carbonyl]amino]ethyl]-6-oxo-, methyl ester
Preferred Name English
Methyl 2-(2-(benzyloxycarbonylamino)propan-2-yl)-5-hydroxy-6-oxo-1,6-dihydropyrimidine-4-carboxylate
Systematic Name English
Methyl 1,6-dihydro-5-hydroxy-2-[1-methyl-1-[[(phenylmethoxy)carbonyl]amino]ethyl]-6-oxo-4-pyrimidinecarboxylate
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID10715719
Created by admin on Wed Apr 02 19:32:44 GMT 2025 , Edited by admin on Wed Apr 02 19:32:44 GMT 2025
PRIMARY
PUBCHEM
135446261
Created by admin on Wed Apr 02 19:32:44 GMT 2025 , Edited by admin on Wed Apr 02 19:32:44 GMT 2025
PRIMARY
CAS
519032-08-7
Created by admin on Wed Apr 02 19:32:44 GMT 2025 , Edited by admin on Wed Apr 02 19:32:44 GMT 2025
PRIMARY
FDA UNII
TD9P5W8AF2
Created by admin on Wed Apr 02 19:32:44 GMT 2025 , Edited by admin on Wed Apr 02 19:32:44 GMT 2025
PRIMARY