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Details

Stereochemistry ACHIRAL
Molecular Formula C21H21FN6O8S
Molecular Weight 536.49
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2H-PYRIDO(3,2-B)-1,4-OXAZIN-3(4H)-ONE, 6-((2-((3,5-DIMETHOXY-4-(SULFOOXY)PHENYL)AMINO)-5-FLUORO-4-PYRIMIDINYL)AMINO)-2,2-DIMETHYL-

SMILES

COC1=CC(NC2=NC=C(F)C(NC3=CC=C4OC(C)(C)C(=O)NC4=N3)=N2)=CC(OC)=C1OS(O)(=O)=O

InChI

InChIKey=ZXZMCWWGCHBLBI-UHFFFAOYSA-N
InChI=1S/C21H21FN6O8S/c1-21(2)19(29)27-18-12(35-21)5-6-15(26-18)25-17-11(22)9-23-20(28-17)24-10-7-13(33-3)16(14(8-10)34-4)36-37(30,31)32/h5-9H,1-4H3,(H,30,31,32)(H3,23,24,25,26,27,28,29)

HIDE SMILES / InChI

Approval Year

Name Type Language
2H-PYRIDO(3,2-B)-1,4-OXAZIN-3(4H)-ONE, 6-((2-((3,5-DIMETHOXY-4-(SULFOOXY)PHENYL)AMINO)-5-FLUORO-4-PYRIMIDINYL)AMINO)-2,2-DIMETHYL-
Systematic Name English
6-((2-((3,5-DIMETHOXY-4-(SULFOOXY)PHENYL)AMINO)-5-FLUORO-4-PYRIMIDINYL)AMINO)-2,2-DIMETHYL-2H-PYRIDO(3,2-B)-1,4-OXAZIN-3(4H)-ONE
Systematic Name English
O-SULFO R-529
Code English
M537
Common Name English
Code System Code Type Description
PUBCHEM
146675115
Created by admin on Thu Jul 06 21:39:59 UTC 2023 , Edited by admin on Thu Jul 06 21:39:59 UTC 2023
PRIMARY
CAS
1293999-48-0
Created by admin on Thu Jul 06 21:39:59 UTC 2023 , Edited by admin on Thu Jul 06 21:39:59 UTC 2023
PRIMARY
FDA UNII
T441NJ0BM5
Created by admin on Thu Jul 06 21:39:59 UTC 2023 , Edited by admin on Thu Jul 06 21:39:59 UTC 2023
PRIMARY