BMS-955176 HCl

Catalog No. :
ACGPNX481
CAS No. :
2023808-13-9
Molecular Formula :
C42H63ClN2O4S
Molecular Weight :
727.50

IUPAC Name:4-((1R,3aS,5aR,5bR,7aR,11aS,11bR,13aR,13bR)-3a-((2-(1,1-dioxidothiomorpholino)ethyl)amino)-5a,5b,8,8,11a-pentamethyl-1-(prop-1-en-2-yl)-2,3,3a,4,5,5a,5b,6,7,7a,8,11,11a,11b,12,13,13a,13b-octadecahydro-1H-cyclopenta[a]chrysen-9-yl)benzoic acid hydrochloride

BMS-955176 HCl structure diagram
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Product Information

Product NameBMS-955176 HCl
IUPAC Name4-((1R,3aS,5aR,5bR,7aR,11aS,11bR,13aR,13bR)-3a-((2-(1,1-dioxidothiomorpholino)ethyl)amino)-5a,5b,8,8,11a-pentamethyl-1-(prop-1-en-2-yl)-2,3,3a,4,5,5a,5b,6,7,7a,8,11,11a,11b,12,13,13a,13b-octadecahydro-1H-cyclopenta[a]chrysen-9-yl)benzoic acid hydrochloride
Molecular FormulaC42H63ClN2O4S
Molecular Weight727.50
SMILESO=C(O)C1=CC=C(C2=CC[C@@]3(C)[C@@](C2(C)C)([H])CC[C@@]4(C)[C@]5(C)CC[C@](CC[C@H]6C(C)=C)(NCCN(CC7)CCS7(=O)=O)[C@@]6([H])[C@@]5([H])CC[C@]34[H])C=C1.[H]Cl
InChI KeyTVYCVCAKXLKPFJ-BRHUKUJJSA-N
SynonymBMS-955176 HCl
CAS No.2023808-13-9

Synthetic Route by SureRoute

1. ACGPNX481 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Then
  3. ACGPNX481 route product structure diagram
    ACGPNX4812023808-13-9
Inquiry

2. ACGPNX481 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Then
  3. ACGPNX481 route product structure diagram
    ACGPNX4812023808-13-9
Inquiry

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