CAS
832715-03-4 Purity
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832715-03-4 Purity
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![[s-Methanethiosulfonylcysteaminyl]ethylenediamine-N,N,N',N'-tetraacetic acid(4:1 mixture of mono-mts to bis-mts)](https://resource.alfa-chemistry.com/structure/832733-28-5.gif)
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Sodium 4-{[(1R)-2-[5-(2-fluoro-3-methoxyphenyl)-3-{[2-fluoro-6-(trifluoromethyl)phenyl]methyl}-4-methyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-1-yl]-1-phenylethyl]amino}butanoate
CAS
832720-36-2
Catalog Number
ACM832720362
Category
Other Products
Molecular Weight
653.5715
Molecular Formula
C32H29F5N3NaO5
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Specification
Synonyms
Elagolix sodium; UNII-5948VUI423;
IUPAC Name
sodium;4-[[(1R)-2-[5-(2-fluoro-3-methoxyphenyl)-3-[[2-fluoro-6-(trifluoromethyl)phenyl]methyl]-4-methyl-2,6-dioxopyrimidin-1-yl]-1-phenylethyl]amino]butanoate
Canonical SMILES
CC1=C(C(=O)N(C(=O)N1CC2=C(C=CC=C2F)C(F)(F)F)CC(C3=CC=CC=C3)NCCCC(=O)[O-])C4=C(C(=CC=C4)OC)F.[Na+]
InChI Key
DQYGXRQUFSRDCH-UQIIZPHYSA-M
Exact Mass
653.19300
H-Bond Acceptor
11
H-Bond Donor
1
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