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

Details

Stereochemistry ABSOLUTE
Molecular Formula C23H20ClF6N5O5
Molecular Weight 595.879
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of RIBUVAPTAN

SMILES

NC(=O)OC[C@H](NC(=O)CN1N=C(N(C[C@H](O)C(F)(F)F)C1=O)C2=CC=C(Cl)C=C2)C3=CC=CC(=C3)C(F)(F)F

InChI

InChIKey=JYRCFPAYSZZCBP-IRXDYDNUSA-N
InChI=1S/C23H20ClF6N5O5/c24-15-6-4-12(5-7-15)19-33-35(21(39)34(19)9-17(36)23(28,29)30)10-18(37)32-16(11-40-20(31)38)13-2-1-3-14(8-13)22(25,26)27/h1-8,16-17,36H,9-11H2,(H2,31,38)(H,32,37)/t16-,17-/m0/s1

HIDE SMILES / InChI

Molecular Formula C23H20ClF6N5O5
Molecular Weight 595.879
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Ribuvaptan (BAY 868050) is a vasopressin receptor antagonist that has been developed for treatment of heart failure. No information on current use is available.

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:47:05 GMT 2023
Edited
by admin
on Sat Dec 16 09:47:05 GMT 2023
Record UNII
6004MB8Y0D
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
RIBUVAPTAN
INN   WHO-DD  
INN  
Official Name English
ribuvaptan [INN]
Common Name English
Ribuvaptan [WHO-DD]
Common Name English
1H-1,2,4-TRIAZOLE-1-ACETAMIDE, N-((1R)-2-((AMINOCARBONYL)OXY)-1-(3-(TRIFLUOROMETHYL)PHENYL)ETHYL)-3-(4-CHLOROPHENYL)-4,5-DIHYDRO-5-OXO-4-((2S)-3,3,3-TRIFLUORO-2-HYDROXYPROPYL)-
Systematic Name English
Classification Tree Code System Code
NCI_THESAURUS C2180
Created by admin on Sat Dec 16 09:47:05 GMT 2023 , Edited by admin on Sat Dec 16 09:47:05 GMT 2023
Code System Code Type Description
NCI_THESAURUS
C152211
Created by admin on Sat Dec 16 09:47:05 GMT 2023 , Edited by admin on Sat Dec 16 09:47:05 GMT 2023
PRIMARY
PUBCHEM
72725085
Created by admin on Sat Dec 16 09:47:05 GMT 2023 , Edited by admin on Sat Dec 16 09:47:05 GMT 2023
PRIMARY
CAS
1245620-47-6
Created by admin on Sat Dec 16 09:47:05 GMT 2023 , Edited by admin on Sat Dec 16 09:47:05 GMT 2023
PRIMARY
INN
9845
Created by admin on Sat Dec 16 09:47:05 GMT 2023 , Edited by admin on Sat Dec 16 09:47:05 GMT 2023
PRIMARY
SMS_ID
300000036938
Created by admin on Sat Dec 16 09:47:05 GMT 2023 , Edited by admin on Sat Dec 16 09:47:05 GMT 2023
PRIMARY
FDA UNII
6004MB8Y0D
Created by admin on Sat Dec 16 09:47:05 GMT 2023 , Edited by admin on Sat Dec 16 09:47:05 GMT 2023
PRIMARY
Related Record Type Details
TARGET -> INHIBITOR
TARGET -> INHIBITOR
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ACTIVE MOIETY