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Details

Stereochemistry ACHIRAL
Molecular Formula C26H36N2O5S2
Molecular Weight 520.704
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Ritivixibat

SMILES

CCCCC1(CCCC)CN(C2=CC=CC=C2)C3=CC(SC)=C(OCCC(O)=O)C=C3S(=O)(=O)N1

InChI

InChIKey=XHOVXESPVIUTMC-UHFFFAOYSA-N
InChI=1S/C26H36N2O5S2/c1-4-6-14-26(15-7-5-2)19-28(20-11-9-8-10-12-20)21-17-23(34-3)22(33-16-13-25(29)30)18-24(21)35(31,32)27-26/h8-12,17-18,27H,4-7,13-16,19H2,1-3H3,(H,29,30)

HIDE SMILES / InChI

Molecular Formula C26H36N2O5S2
Molecular Weight 520.704
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 19:23:42 UTC 2023
Edited
by admin
on Sat Dec 16 19:23:42 UTC 2023
Record UNII
3U7H6NE2KE
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Ritivixibat
INN  
Official Name English
ritivixibat [INN]
Common Name English
3-{[3,3-dibutyl-7-(methylsulfanyl)-1,1-dioxo-5-phenyl- 2,3,4,5-tetrahydro-1,2,5-benzothiadiazepin-8-yl]oxy}- propanoic acid
Systematic Name English
Propanoic acid, 3-[[3,3-dibutyl-2,3,4,5-tetrahydro-7-(methylthio)-1,1-dioxido-5-phenyl-1,2,5-benzothiadiazepin-8-yl]oxy]-
Systematic Name English
3-{[3,3-dibutyl-7-(methylsulfanyl)-1,1-dioxo-5-phenyl- 2,3,4,5-tetrahydro-1,2,5-benzothiadiazepin-8-yl]oxy}- propanoic acid
Systematic Name English
3-([3,3-Dibutyl-7-(methylsulfanyl)-1,1-dioxo-5-phenyl-2,3,4,5-tetrahydro-1H-1Lambda6,2,5-benzothiadiazepin-8-yl]oxy)propanoic acid
Code English
Classification Tree Code System Code
FDA ORPHAN DRUG 910222
Created by admin on Sat Dec 16 19:23:42 UTC 2023 , Edited by admin on Sat Dec 16 19:23:42 UTC 2023
Code System Code Type Description
NCI_THESAURUS
C199105
Created by admin on Sat Dec 16 19:23:42 UTC 2023 , Edited by admin on Sat Dec 16 19:23:42 UTC 2023
PRIMARY
FDA UNII
3U7H6NE2KE
Created by admin on Sat Dec 16 19:23:42 UTC 2023 , Edited by admin on Sat Dec 16 19:23:42 UTC 2023
PRIMARY
CAS
2460667-52-9
Created by admin on Sat Dec 16 19:23:42 UTC 2023 , Edited by admin on Sat Dec 16 19:23:42 UTC 2023
PRIMARY
INN
12511
Created by admin on Sat Dec 16 19:23:42 UTC 2023 , Edited by admin on Sat Dec 16 19:23:42 UTC 2023
PRIMARY
PUBCHEM
154618785
Created by admin on Sat Dec 16 19:23:42 UTC 2023 , Edited by admin on Sat Dec 16 19:23:42 UTC 2023
PRIMARY
Related Record Type Details
TARGET -> INHIBITOR
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