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Details

Stereochemistry ABSOLUTE
Molecular Formula C24H19F2N3O4S
Molecular Weight 483.487
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BALOXAVIR

SMILES

OC1=C2N(C=CC1=O)N([C@@H]3COCCN3C2=O)[C@@H]4C5=CC=CC=C5SCC6=C(F)C(F)=CC=C46

InChI

InChIKey=FIDLLEYNNRGVFR-CTNGQTDRSA-N
InChI=1S/C24H19F2N3O4S/c25-16-6-5-13-15(20(16)26)12-34-18-4-2-1-3-14(18)21(13)29-19-11-33-10-9-27(19)24(32)22-23(31)17(30)7-8-28(22)29/h1-8,19,21,31H,9-12H2/t19-,21+/m1/s1

HIDE SMILES / InChI

Molecular Formula C24H19F2N3O4S
Molecular Weight 483.487
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Tue Oct 22 01:57:34 UTC 2019
Edited
by admin
on Tue Oct 22 01:57:34 UTC 2019
Record UNII
4G86Y4JT3F
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BALOXAVIR
USAN  
Official Name English
(12AR)-12-((11S)-7,8-DIFLUORO-6,11-DIHYDRODIBENZO(B,E)THIEPIN-11-YL)-7-HYDROXY-3,4,12,12A-TETRAHYDRO-1H-(1,4)OXAZINO(3,4-C)PYRIDO(2,1-F)(1,2,4)TRIAZINE-6,8-DIONE
Systematic Name English
S-033447
Code English
1H-(1,4)OXAZINO(3,4-C)PYRIDO(2,1-F)(1,2,4)TRIAZINE-6,8-DIONE, 12-((11S)-7,8-DIFLUORO-6,11-DIHYDRODIBENZO(B,E)THIEPIN-11-YL)-3,4,12,12A-TETRAHYDRO-7-HYDROXY-, (12AR)-
Systematic Name English
BALOXAVIR [USAN]
Common Name English
Code System Code Type Description
CAS
1985605-59-1
Created by admin on Tue Oct 22 01:57:34 UTC 2019 , Edited by admin on Tue Oct 22 01:57:34 UTC 2019
PRIMARY
PUBCHEM
124081876
Created by admin on Tue Oct 22 01:57:34 UTC 2019 , Edited by admin on Tue Oct 22 01:57:34 UTC 2019
PRIMARY
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