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

Details

Stereochemistry ABSOLUTE
Molecular Formula C20H17ClN3O3P
Molecular Weight 413.794
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of FOSDEVIRINE

SMILES

CO[P@](=O)(C1=C(NC2=CC=C(Cl)C=C12)C(N)=O)C3=CC(\C=C\C#N)=CC(C)=C3

InChI

InChIKey=CGBYTKOSZYQOPV-CCEZBSFNSA-N
InChI=1S/C20H17ClN3O3P/c1-12-8-13(4-3-7-22)10-15(9-12)28(26,27-2)19-16-11-14(21)5-6-17(16)24-18(19)20(23)25/h3-6,8-11,24H,1-2H3,(H2,23,25)/b4-3+/t28-/m0/s1

HIDE SMILES / InChI

Molecular Formula C20H17ClN3O3P
Molecular Weight 413.794
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 1
Optical Activity UNSPECIFIED

Substance Class Chemical
Created
by admin
on Fri Dec 15 18:27:56 UTC 2023
Edited
by admin
on Fri Dec 15 18:27:56 UTC 2023
Record UNII
Z4I0C281BJ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
FOSDEVIRINE
INN   USAN   WHO-DD  
USAN   INN  
Official Name English
GSK 2248761A
Code English
fosdevirine [INN]
Common Name English
PHOSPHINIC ACID, P-(2-(AMINOCARBONYL)-5-CHLORO-1H-INDOL-3-YL)-P-(3-((1E)-2- CYANOETHENYL)-5-METHYLPHENYL)-, METHYL ESTER, (P(R))-
Common Name English
GSK2248761A
Code English
GSK-2248761
Code English
(2-CARBAMOYL-5-CHLORO-1H-INDOL-3-YL)-(3-(E)-2-CYANO-VINYL)-5-METHYL-PHENYL))-(R)-PHOSPINIC ACID METHYL ESTER
Common Name English
Methyl (R)-P-(2-carbamoyl-5-chloro-1H-indol-3-yl)-P-{3-[(1E)-2-cyanoethenyl]-5-methylphenyl}phosphinate
Systematic Name English
Fosdevirine [WHO-DD]
Common Name English
GSK-2248761A
Code English
FOSDEVIRINE [USAN]
Common Name English
IDX-899
Code English
IDX899
Code English
Code System Code Type Description
USAN
WW-17
Created by admin on Fri Dec 15 18:27:56 UTC 2023 , Edited by admin on Fri Dec 15 18:27:56 UTC 2023
PRIMARY
FDA UNII
Z4I0C281BJ
Created by admin on Fri Dec 15 18:27:56 UTC 2023 , Edited by admin on Fri Dec 15 18:27:56 UTC 2023
PRIMARY
NCI_THESAURUS
C170008
Created by admin on Fri Dec 15 18:27:56 UTC 2023 , Edited by admin on Fri Dec 15 18:27:56 UTC 2023
PRIMARY
ChEMBL
CHEMBL2104968
Created by admin on Fri Dec 15 18:27:56 UTC 2023 , Edited by admin on Fri Dec 15 18:27:56 UTC 2023
PRIMARY
SMS_ID
100000174902
Created by admin on Fri Dec 15 18:27:56 UTC 2023 , Edited by admin on Fri Dec 15 18:27:56 UTC 2023
PRIMARY
EPA CompTox
DTXSID501031227
Created by admin on Fri Dec 15 18:27:56 UTC 2023 , Edited by admin on Fri Dec 15 18:27:56 UTC 2023
PRIMARY
INN
9289
Created by admin on Fri Dec 15 18:27:56 UTC 2023 , Edited by admin on Fri Dec 15 18:27:56 UTC 2023
PRIMARY
CAS
1018450-26-4
Created by admin on Fri Dec 15 18:27:56 UTC 2023 , Edited by admin on Fri Dec 15 18:27:56 UTC 2023
PRIMARY
PUBCHEM
44224276
Created by admin on Fri Dec 15 18:27:56 UTC 2023 , Edited by admin on Fri Dec 15 18:27:56 UTC 2023
PRIMARY
DRUG BANK
DB06166
Created by admin on Fri Dec 15 18:27:56 UTC 2023 , Edited by admin on Fri Dec 15 18:27:56 UTC 2023
PRIMARY
WIKIPEDIA
Fosdevirine
Created by admin on Fri Dec 15 18:27:56 UTC 2023 , Edited by admin on Fri Dec 15 18:27:56 UTC 2023
PRIMARY
Related Record Type Details
TARGET -> INHIBITOR
TARGET ORGANISM->INHIBITOR
Related Record Type Details
ACTIVE MOIETY