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CAS 1041389-28-9

:

(3S,4aS,8aS)-N-(1,1-Dimethylethyl)decahydro-2-[(2R,3R)-2-hydroxy-3-[(3-hydroxy-2-methylbenzoyl)amino]-4-(phenylsulfinyl)butyl]-3-isoquinolinecarboxamide

Description:
The chemical substance with the name "(3S,4aS,8aS)-N-(1,1-Dimethylethyl)decahydro-2-[(2R,3R)-2-hydroxy-3-[(3-hydroxy-2-methylbenzoyl)amino]-4-(phenylsulfinyl)butyl]-3-isoquinolinecarboxamide" and CAS number "1041389-28-9" is a complex organic compound characterized by its multi-ring structure and various functional groups. It features an isoquinoline core, which is a bicyclic structure known for its presence in many biologically active compounds. The presence of a decahydro moiety indicates a saturated hydrocarbon framework, while the inclusion of hydroxyl (-OH) and amide (-CONH-) groups suggests potential for hydrogen bonding and solubility in polar solvents. The compound also contains a phenylsulfinyl group, which may contribute to its reactivity and biological activity. Its stereochemistry, indicated by the specific configurations at various chiral centers, is crucial for its interaction with biological targets. Overall, this compound may have applications in medicinal chemistry, particularly in the development of pharmaceuticals, due to its intricate structure and functional diversity.
Formula:C32H45N3O5S
InChI:InChI=1S/C32H45N3O5S/c1-21-25(15-10-16-28(21)36)30(38)33-26(20-41(40)24-13-6-5-7-14-24)29(37)19-35-18-23-12-9-8-11-22(23)17-27(35)31(39)34-32(2,3)4/h5-7,10,13-16,22-23,26-27,29,36-37H,8-9,11-12,17-20H2,1-4H3,(H,33,38)(H,34,39)/t22-,23+,26-,27-,29+,41?/m0/s1
InChI key:InChIKey=RSOLVRGGAAUFHC-VSAYVLMCSA-N
SMILES:C(NC(C)(C)C)(=O)[C@H]1N(C[C@H]([C@@H](NC(=O)C2=C(C)C(O)=CC=C2)CS(=O)C3=CC=CC=C3)O)C[C@@]4([C@](C1)(CCCC4)[H])[H]
Synonyms:
  • 3-Isoquinolinecarboxamide, N-(1,1-dimethylethyl)decahydro-2-[(2R,3R)-2-hydroxy-3-[(3-hydroxy-2-methylbenzoyl)amino]-4-(phenylsulfinyl)butyl]-, (3S,4aS,8aS)-
  • (3S,4aS,8aS)-N-(1,1-Dimethylethyl)decahydro-2-[(2R,3R)-2-hydroxy-3-[(3-hydroxy-2-methylbenzoyl)amino]-4-(phenylsulfinyl)butyl]-3-isoquinolinecarboxamide
  • Nelfinavir Sulfoxide Impurity
  • Nelfinavir Related Compound A ((3S,4aS,8aS)-N-tert-Butyl-2-[(2R,3R)-2-hydroxy-3-(3-hydroxy-2-methyl (1457979)
  • Nelfinavir Related CoMpound A
  • Nelfinavir USP RC A
  • (3S,4aS,8aS)-2-[(2R,3R)-4-(benzenesulfinyl)-2-hydroxy-3-[(3-hydroxy-2-methylbenzoyl)amino]butyl]-N-tert-butyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinoline-3-carboxamide
  • Nelfinavir Sulphoxide Impurity
  • Nelfinavir Related Compound A (15 mg)
  • Nelfinavir Sulfoxide
  • See more synonyms
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Found 3 products.
  • Nelfinavir Impurity 2
    TLC
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    Nelfinavir Impurity 2

    CAS:
    Formula:C32H45N3O5S
    Molecular weight:583.80

    Ref: 4Z-N-044

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  • Nelfinavir Sulfoxide
    TRC
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    Nelfinavir Sulfoxide

    Controlled Product
    CAS:
    <p>Impurity Nelfinavir USP Related Compound A<br>Applications Nelfinavir Sulfoxide is an impurity of Nelfinavir Mesylate (N389750). Nelfinavir USP Related Compound A. It is a COVID19-related research product.<br>References Aymard, G., et al.: J. Chromatogr. B, 744, 227 (2000), Jing, Q., et al.: J. Pharm. Biomed. Anal., 41, 1065 (2006),<br></p>
    Formula:C32H45N3O5S
    Color and Shape:Neat
    Molecular weight:583.78

    Ref: TR-N389770

    250mg
    1,530.00€
  • Nelfinavir Sulfoxide Impurity
    Standalix
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    Nelfinavir Sulfoxide Impurity

    CAS:
    Formula:C32H45N3O5S
    Molecular weight:583.8

    Ref: ST-EA-CP-N112004

    10mg
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    25mg
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    50mg
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    100mg
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