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Substance Name: MDL 74695
RN: 167486-23-9
InChIKey: JUZBHZAPSATRCS-KVBYWJEESA-N

Molecular Formula

  • C41-H53-F2-N5-O8

Molecular Weight

  • 781.8927
 
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Names and Synonyms

Results Name

  • MDL 74695

Synonyms

  • MDL 74,695
  • MDL 74695

Systematic Name

  • 2-Oxa-5,10,13-triazatetradecan-14-oic acid, 7,7-difluoro-4,12-bis(1-methylethyl)-9-((4-(2-(4-morpholinyl)ethoxy)phenyl)methyl)-6,8,11-trioxo-1-(3-pyridinyl)-, phenylmethyl ester, (4R-(4R*,9S*,12S*))-

Registry Numbers

CAS Registry Number

  • 167486-23-9

System Generated Number

  • 0167486239

Structure Descriptors

InChI

1S/C41H53F2N5O8/c1-28(2)35(27-54-25-32-11-8-16-44-24-32)46-39(51)41(42,43)37(49)34(23-30-12-14-33(15-13-30)55-22-19-48-17-20-53-21-18-48)45-38(50)36(29(3)4)47-40(52)56-26-31-9-6-5-7-10-31/h5-16,24,28-29,34-36H,17-23,25-27H2,1-4H3,(H,45,50)(H,46,51)(H,47,52)/t34-,35-,36-/m0/s1

InChIKey

JUZBHZAPSATRCS-KVBYWJEESA-N

Smiles

CC(C)[C@H](COCc1cccnc1)NC(=O)C(C(=O)[C@H](Cc2ccc(cc2)OCCN3CCOCC3)NC(=O)[C@H](C(C)C)NC(=O)OCc4ccccc4)(F)F