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Details

Stereochemistry ACHIRAL
Molecular Formula C23H20FN4O8P.2Na
Molecular Weight 576.3786
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Disodium [[2-[5-[(3-cyano-4-fluorophenyl)carbamoyl]-1,2,4-trimethylpyrrol-3-yl]-2-oxoacetyl]-(3-ethynyloxetan-3-yl)amino]methyl phosphate

SMILES

[Na+].[Na+].CN1C(C)=C(C(=O)C(=O)N(COP([O-])([O-])=O)C2(COC2)C#C)C(C)=C1C(=O)NC3=CC=C(F)C(=C3)C#N

InChI

InChIKey=AZODBEIBQSHYDI-UHFFFAOYSA-L
InChI=1S/C23H22FN4O8P.2Na/c1-5-23(10-35-11-23)28(12-36-37(32,33)34)22(31)20(29)18-13(2)19(27(4)14(18)3)21(30)26-16-6-7-17(24)15(8-16)9-25;;/h1,6-8H,10-12H2,2-4H3,(H,26,30)(H2,32,33,34);;/q;2*+1/p-2

HIDE SMILES / InChI

Approval Year

Name Type Language
1H-Pyrrole-3-acetamide, 5-[[(3-cyano-4-fluorophenyl)amino]carbonyl]-N-(3-ethynyl-3-oxetanyl)-1,2,4-trimethyl-?-oxo-N-[(phosphonooxy)methyl]-, sodium salt (1:2)
Preferred Name English
Disodium [[2-[5-[(3-cyano-4-fluorophenyl)carbamoyl]-1,2,4-trimethylpyrrol-3-yl]-2-oxoacetyl]-(3-ethynyloxetan-3-yl)amino]methyl phosphate
Common Name English
Disodium;[[2-[5-[(3-cyano-4-fluorophenyl)carbamoyl]-1,2,4-trimethylpyrrol-3-yl]-2-oxoacetyl]-(3-ethynyloxetan-3-yl)amino]methyl phosphate
Systematic Name English
Code System Code Type Description
SMS_ID
300000027019
Created by admin on Wed Apr 02 21:05:19 GMT 2025 , Edited by admin on Wed Apr 02 21:05:19 GMT 2025
PRIMARY
CAS
2495324-72-4
Created by admin on Wed Apr 02 21:05:19 GMT 2025 , Edited by admin on Wed Apr 02 21:05:19 GMT 2025
PRIMARY
FDA UNII
QUF596Z92T
Created by admin on Wed Apr 02 21:05:19 GMT 2025 , Edited by admin on Wed Apr 02 21:05:19 GMT 2025
PRIMARY
PUBCHEM
155625942
Created by admin on Wed Apr 02 21:05:19 GMT 2025 , Edited by admin on Wed Apr 02 21:05:19 GMT 2025
PRIMARY