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Substance Name: Thieno(3,2-c)pyridine-6-carboxamide, N-(1,1-dimethylethyl)-5-(3-((3-((4-fluorophenyl)sulfonyl)-2-((methylsulfonyl)amino)-1-oxopropyl)amino)-2-hydroxy-4-phenylbutyl)octahydro-, (3aR-(3aalpha,5(2R*,3S*(S*)),6beta,7aalpha))-
RN: 169168-43-8
InChIKey: LYXPKYLWOJGHAC-CMMBNUEMSA-N

Molecular Formula

  • C32-H45-F-N4-O7-S3

Molecular Weight

  • 712.9245
 
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Names and Synonyms

  • Thieno(3,2-c)pyridine-6-carboxamide, N-(1,1-dimethylethyl)-5-(3-((3-((4-fluorophenyl)sulfonyl)-2-((methylsulfonyl)amino)-1-oxopropyl)amino)-2-hydroxy-4-phenylbutyl)octahydro-, (3aR-(3aalpha,5(2R*,3S*(S*)),6beta,7aalpha))-

Registry Numbers

CAS Registry Number

  • 169168-43-8

System Generated Number

  • 0169168438

Structure Descriptors

InChI

1S/C32H45FN4O7S3/c1-32(2,3)35-31(40)27-17-29-22(14-15-45-29)18-37(27)19-28(38)25(16-21-8-6-5-7-9-21)34-30(39)26(36-46(4,41)42)20-47(43,44)24-12-10-23(33)11-13-24/h5-13,22,25-29,36,38H,14-20H2,1-4H3,(H,34,39)(H,35,40)/t22-,25+,26-,27+,28-,29+/m1/s1

InChIKey

LYXPKYLWOJGHAC-CMMBNUEMSA-N

Smiles

CC(C)(C)NC(=O)[C@@H]1C[C@H]2[C@H](CCS2)CN1C[C@H]([C@H](Cc3ccccc3)NC(=O)[C@@H](CS(=O)(=O)c4ccc(cc4)F)NS(=O)(=O)C)O