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

Details

Stereochemistry ACHIRAL
Molecular Formula C26H31N5O4
Molecular Weight 477.5554
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of ENSIFENTRINE

SMILES

COC1=C(OC)C=C2C(CCN3C(=O)N(CCNC(N)=O)\C(C=C23)=N\C4=C(C)C=C(C)C=C4C)=C1

InChI

InChIKey=CSOBIBXVIYAXFM-BYNJWEBRSA-N
InChI=1S/C26H31N5O4/c1-15-10-16(2)24(17(3)11-15)29-23-14-20-19-13-22(35-5)21(34-4)12-18(19)6-8-30(20)26(33)31(23)9-7-28-25(27)32/h10-14H,6-9H2,1-5H3,(H3,27,28,32)/b29-23+

HIDE SMILES / InChI

Molecular Formula C26H31N5O4
Molecular Weight 477.5554
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Patents
Substance Class Chemical
Created
by admin
on Sat Dec 16 06:45:11 GMT 2023
Edited
by admin
on Sat Dec 16 06:45:11 GMT 2023
Record UNII
3E3D8T1GIX
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ENSIFENTRINE
USAN   INN  
Official Name English
LS-193855
Common Name English
ensifentrine [INN]
Common Name English
ENSIFENTRINE [USAN]
Common Name English
RPL-554
Code English
Ensifentrine [WHO-DD]
Common Name English
N-(2-((2E)-9,10-DIMETOXI-4-OXO-2-((2,4,6-TRIMETILFENIL)IMINO)-6,7-DIHIDRO-2H-PIRIMIDO(6,1-A)ISOQUINOLEIN-3(4H)-IL)ETIL)UREA
Systematic Name English
2-(9,10-DIMETHOXY-4-OXO-2-(2,4,6-TRIMETHYLPHENYL)IMINO-6,7-DIHYDROPYRIMIDO(6,1-A)ISOQUINOLIN-3-YL)ETHYLUREA
Systematic Name English
LS-193,855
Common Name English
UREA, N-(2-(6,7-DIHYDRO-9,10-DIMETHOXY-4-OXO-2-((2,4,6-TRIMETHYLPHENYL)IMINO)-2H-PYRIMIDO(6,1-A)ISOQUINOLIN-3(4H)-YL)ETHYL)-
Systematic Name English
Code System Code Type Description
USAN
HI-47
Created by admin on Sat Dec 16 06:45:11 GMT 2023 , Edited by admin on Sat Dec 16 06:45:11 GMT 2023
PRIMARY
CAS
1884461-72-6
Created by admin on Sat Dec 16 06:45:11 GMT 2023 , Edited by admin on Sat Dec 16 06:45:11 GMT 2023
PRIMARY
INN
10726
Created by admin on Sat Dec 16 06:45:11 GMT 2023 , Edited by admin on Sat Dec 16 06:45:11 GMT 2023
PRIMARY
SMS_ID
100000183572
Created by admin on Sat Dec 16 06:45:11 GMT 2023 , Edited by admin on Sat Dec 16 06:45:11 GMT 2023
PRIMARY
FDA UNII
3E3D8T1GIX
Created by admin on Sat Dec 16 06:45:11 GMT 2023 , Edited by admin on Sat Dec 16 06:45:11 GMT 2023
PRIMARY
EPA CompTox
DTXSID00183983
Created by admin on Sat Dec 16 06:45:11 GMT 2023 , Edited by admin on Sat Dec 16 06:45:11 GMT 2023
PRIMARY
CAS
298680-25-8
Created by admin on Sat Dec 16 06:45:11 GMT 2023 , Edited by admin on Sat Dec 16 06:45:11 GMT 2023
NON-SPECIFIC STEREOCHEMISTRY
PUBCHEM
9934746
Created by admin on Sat Dec 16 06:45:11 GMT 2023 , Edited by admin on Sat Dec 16 06:45:11 GMT 2023
PRIMARY
WIKIPEDIA
RPL-554
Created by admin on Sat Dec 16 06:45:11 GMT 2023 , Edited by admin on Sat Dec 16 06:45:11 GMT 2023
PRIMARY
NCI_THESAURUS
C166674
Created by admin on Sat Dec 16 06:45:11 GMT 2023 , Edited by admin on Sat Dec 16 06:45:11 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY