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Details

Stereochemistry ACHIRAL
Molecular Formula C23H22FN4O8P
Molecular Weight 532.4149
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

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

SMILES

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=ATLWUNMDEZYXQJ-UHFFFAOYSA-N
InChI=1S/C23H22FN4O8P/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)

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]-
Preferred Name English
[[2-[5-[(3-Cyano-4-fluorophenyl)carbamoyl]-1,2,4-trimethylpyrrol-3-yl]-2-oxoacetyl]-(3-ethynyloxetan-3-yl)amino]methyl dihydrogen phosphate
Systematic Name English
5-[[(3-Cyano-4-fluorophenyl)amino]carbonyl]-N-(3-ethynyl-3-oxetanyl)-1,2,4-trimethyl-?-oxo-N-[(phosphonooxy)methyl]-1H-pyrrole-3-acetamide
Systematic Name English
Code System Code Type Description
CAS
2495324-71-3
Created by admin on Wed Apr 02 20:08:06 GMT 2025 , Edited by admin on Wed Apr 02 20:08:06 GMT 2025
PRIMARY
PUBCHEM
155169288
Created by admin on Wed Apr 02 20:08:06 GMT 2025 , Edited by admin on Wed Apr 02 20:08:06 GMT 2025
PRIMARY
FDA UNII
G9Q8YSG7DD
Created by admin on Wed Apr 02 20:08:06 GMT 2025 , Edited by admin on Wed Apr 02 20:08:06 GMT 2025
PRIMARY