Products 439088-54-7

CAS 439088-54-7 is the registry number for tert-Butyl Elobixibat. Offered by: TRC. Available pack sizes: 50mg.

tert-Butyl Elobixibat
TRC
  • size: 50mg
  • Variants: 1
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Structural formula: {0} (CAS {1})

Tert-butyl 2-[[(2R)-2-[[2-[(3,3-dibutyl-7-methylsulfanyl-1,1-dioxo-5-phenyl-2,4-dihydro-1lambda6,5-benzothiazepin-8-yl)oxy]acetyl]amino]-2-phenylacetyl]amino]acetate (CAS 439088-54-7) is a chemical compound with the molecular formula C40H53N3O7S2 and a molecular weight of 752.0 g/mol. IUPAC name: tert-butyl 2-[[(2R)-2-[[2-[(3,3-dibutyl-7-methylsulfanyl-1,1-dioxo-5-phenyl-2,4-dihydro-1lambda6,5-benzothiazepin-8-yl)oxy]acetyl]amino]-2-phenylacetyl]amino]acetate. InChIKey: XSVUMBDBVUKDQT-DIPNUNPCSA-N.

Identity
Molecular formulaC40H53N3O7S2
Molecular weight752.0 g/mol
IUPAC nametert-butyl 2-[[(2R)-2-[[2-[(3,3-dibutyl-7-methylsulfanyl-1,1-dioxo-5-phenyl-2,4-dihydro-1lambda6,5-benzothiazepin-8-yl)oxy]acetyl]amino]-2-phenylacetyl]amino]acetate
InChIKeyXSVUMBDBVUKDQT-DIPNUNPCSA-N
SMILESCCCCC1(CN(C2=CC(=C(C=C2S(=O)(=O)C1)OCC(=O)N[C@H](C3=CC=CC=C3)C(=O)NCC(=O)OC(C)(C)C)SC)C4=CC=CC=C4)CCCC

Computed by PubChem (NCBI)

Synonyms: tert-Butyl Elobixibat, Elobixibat Impurity 23