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

Details

Stereochemistry ACHIRAL
Molecular Formula C23H25FN6O6
Molecular Weight 500.4796
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 6-[[5-Fluoro-2-(3,4,5-trimethoxyanilino)pyrimidin-4-yl]amino]-4-(hydroxymethyl)-2,2-dimethylpyrido[3,2-b][1,4]oxazin-3-one

SMILES

COC1=CC(NC2=NC=C(F)C(NC3=CC=C4OC(C)(C)C(=O)N(CO)C4=N3)=N2)=CC(OC)=C1OC

InChI

InChIKey=SJCAXKZLEUFCLP-UHFFFAOYSA-N
InChI=1S/C23H25FN6O6/c1-23(2)21(32)30(11-31)20-14(36-23)6-7-17(28-20)27-19-13(24)10-25-22(29-19)26-12-8-15(33-3)18(35-5)16(9-12)34-4/h6-10,31H,11H2,1-5H3,(H2,25,26,27,28,29)

HIDE SMILES / InChI

Approval Year

Name Type Language
6-[[5-Fluoro-2-(3,4,5-trimethoxyanilino)pyrimidin-4-yl]amino]-4-(hydroxymethyl)-2,2-dimethylpyrido[3,2-b][1,4]oxazin-3-one
Systematic Name English
2H-Pyrido[3,2-b]-1,4-oxazin-3(4H)-one, 6-[[5-fluoro-2-[(3,4,5-trimethoxyphenyl)amino]-4-pyrimidinyl]amino]-4-(hydroxymethyl)-2,2-dimethyl-
Systematic Name English
6-[[5-Fluoro-2-[(3,4,5-trimethoxyphenyl)amino]-4-pyrimidinyl]amino]-4-(hydroxymethyl)-2,2-dimethyl-2H-pyrido[3,2-b]-1,4-oxazin-3(4H)-one
Systematic Name English
Code System Code Type Description
FDA UNII
R92J5U6MJV
Created by admin on Sat Dec 16 19:16:17 GMT 2023 , Edited by admin on Sat Dec 16 19:16:17 GMT 2023
PRIMARY
PUBCHEM
11533408
Created by admin on Sat Dec 16 19:16:17 GMT 2023 , Edited by admin on Sat Dec 16 19:16:17 GMT 2023
PRIMARY
CAS
901119-39-9
Created by admin on Sat Dec 16 19:16:17 GMT 2023 , Edited by admin on Sat Dec 16 19:16:17 GMT 2023
PRIMARY