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Substance Name: Butanamide, N,N'-(2,2-difluoro-3-oxo-1,4-bis(phenylmethyl)-1,4-butanediyl)bis(3-methyl-2-(((2-(2-pyridinyl)ethyl)sulfonyl)amino)-, (1S-(1R*(R*),4R*(R*)))-
RN: 144185-90-0
InChIKey: WONBDGVQWDNJCU-ZQWQDMLBSA-N

Molecular Formula

  • C42-H52-F2-N6-O7-S2

Molecular Weight

  • 855.0358
 
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Names and Synonyms

  • Butanamide, N,N'-(2,2-difluoro-3-oxo-1,4-bis(phenylmethyl)-1,4-butanediyl)bis(3-methyl-2-(((2-(2-pyridinyl)ethyl)sulfonyl)amino)-, (1S-(1R*(R*),4R*(R*)))-

Registry Numbers

CAS Registry Number

  • 144185-90-0

System Generated Number

  • 0144185900

Structure Descriptors

InChI

1S/C42H52F2N6O7S2/c1-29(2)37(49-58(54,55)25-21-33-19-11-13-23-45-33)40(52)47-35(27-31-15-7-5-8-16-31)39(51)42(43,44)36(28-32-17-9-6-10-18-32)48-41(53)38(30(3)4)50-59(56,57)26-22-34-20-12-14-24-46-34/h5-20,23-24,29-30,35-38,49-50H,21-22,25-28H2,1-4H3,(H,47,52)(H,48,53)/t35-,36-,37-,38-/m0/s1

InChIKey

WONBDGVQWDNJCU-ZQWQDMLBSA-N

Smiles

CC(C)[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)C([C@H](Cc2ccccc2)NC(=O)[C@H](C(C)C)NS(=O)(=O)CCc3ccccn3)(F)F)NS(=O)(=O)CCc4ccccn4