(S)-ELAGOLIX SODIUM

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C32H29F5N3O5.Na
Molecular Weight	653.5715
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[Na+].COC1=CC=CC(=C1F)C2=C(C)N(CC3=C(C=CC=C3F)C(F)(F)F)C(=O)N(C[C@@H](NCCCC([O-])=O)C4=CC=CC=C4)C2=O

InChI

InChIKey=DQYGXRQUFSRDCH-VQIWEWKSSA-M

InChI=1S/C32H30F5N3O5.Na/c1-19-28(21-11-6-14-26(45-2)29(21)34)30(43)40(18-25(20-9-4-3-5-10-20)38-16-8-15-27(41)42)31(44)39(19)17-22-23(32(35,36)37)12-7-13-24(22)33;/h3-7,9-14,25,38H,8,15-18H2,1-2H3,(H,41,42);/q;+1/p-1/t25-;/m1./s1

HIDE SMILES / InChI

Approval Year

Name

Type

Language

(S)-ELAGOLIX SODIUM

Common Name

English

Butanoic acid, 4-[[(1S)-2-[5-(2-fluoro-3-methoxyphenyl)-3-[[2-fluoro-6-(trifluoromethyl)phenyl]methyl]-3,6-dihydro-4-methyl-2,6-dioxo-1(2H)-pyrimidinyl]-1-phenylethyl]amino]-, sodium salt (1:1)

Systematic Name

English

Code System Code Type Description

CAS

2756307-49-8

Created by admin on Sat Dec 16 19:23:00 GMT 2023 , Edited by admin on Sat Dec 16 19:23:00 GMT 2023

PRIMARY

FDA UNII

3VM23TT6S9

Created by admin on Sat Dec 16 19:23:00 GMT 2023 , Edited by admin on Sat Dec 16 19:23:00 GMT 2023

PRIMARY

PUBCHEM