U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C18H21N3O6
Molecular Weight 375.3758
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Methyl 5-hydroxy-6-methoxy-2-[1-methyl-1-[[(phenylmethoxy)carbonyl]amino]ethyl]-4-pyrimidinecarboxylate

SMILES

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

InChI

InChIKey=FCCMQMXYACFBJQ-UHFFFAOYSA-N
InChI=1S/C18H21N3O6/c1-18(2,21-17(24)27-10-11-8-6-5-7-9-11)16-19-12(15(23)26-4)13(22)14(20-16)25-3/h5-9,22H,10H2,1-4H3,(H,21,24)

HIDE SMILES / InChI

Approval Year

Name Type Language
Raltegravir RC 2
Preferred Name English
Methyl 5-hydroxy-6-methoxy-2-[1-methyl-1-[[(phenylmethoxy)carbonyl]amino]ethyl]-4-pyrimidinecarboxylate
Systematic Name English
4-Pyrimidinecarboxylic acid, 5-hydroxy-6-methoxy-2-[1-methyl-1-[[(phenylmethoxy)carbonyl]amino]ethyl]-, methyl ester
Systematic Name English
5-hydroxy-2-[1-methyl-1-[[benzylcarbamoyl]amino]ethyl]-6-methoxypyrimidine-4-carboxylic acid methyl ester
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID70675946
Created by admin on Wed Apr 02 20:24:58 GMT 2025 , Edited by admin on Wed Apr 02 20:24:58 GMT 2025
PRIMARY
CAS
1159977-42-0
Created by admin on Wed Apr 02 20:24:58 GMT 2025 , Edited by admin on Wed Apr 02 20:24:58 GMT 2025
PRIMARY
FDA UNII
P7BNY5J4DX
Created by admin on Wed Apr 02 20:24:58 GMT 2025 , Edited by admin on Wed Apr 02 20:24:58 GMT 2025
PRIMARY
PUBCHEM
46781834
Created by admin on Wed Apr 02 20:24:58 GMT 2025 , Edited by admin on Wed Apr 02 20:24:58 GMT 2025
PRIMARY