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Substance Name: BILA 1906 BS
RN: 154612-31-4
InChIKey: IMPWGYVYFQPDFN-SZNOJMITSA-N

Molecular Formula

  • C41-H52-N6-O4-S

Molecular Weight

  • 724.9658
 
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Names and Synonyms

Results Name

  • BILA 1906 BS

Synonym

  • BILA 1906 BS

Systematic Name

  • 2-Quinolinecarboxamide, N-((1S)-1-((((1S,2R)-3-((2S,4R)-2-(((1,1-dimethylethyl)amino)carbonyl)-4-((3-pyridinylmethyl)thio)-1-piperidinyl)-2-hydroxy-1-(phenylmethyl)propyl)amino)carbonyl)-2-methylpropyl)-

Registry Numbers

CAS Registry Number

  • 154612-31-4

System Generated Number

  • 0154612314

Structure Descriptors

InChI

1S/C41H52N6O4S/c1-27(2)37(45-38(49)33-18-17-30-15-9-10-16-32(30)43-33)40(51)44-34(22-28-12-7-6-8-13-28)36(48)25-47-21-19-31(52-26-29-14-11-20-42-24-29)23-35(47)39(50)46-41(3,4)5/h6-18,20,24,27,31,34-37,48H,19,21-23,25-26H2,1-5H3,(H,44,51)(H,45,49)(H,46,50)/t31-,34+,35+,36-,37+/m1/s1

InChIKey

IMPWGYVYFQPDFN-SZNOJMITSA-N

Smiles

CC(C)[C@@H](C(=O)N[C@@H](Cc1ccccc1)[C@@H](CN2CC[C@H](C[C@H]2C(=O)NC(C)(C)C)SCc3cccnc3)O)NC(=O)c4ccc5ccccc5n4