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Substance Name: BIBR-1087SE
RN: 212321-78-3
UNII: 441X78E2Z0
InChIKey: UGEWTLXHMYKLCO-UHFFFAOYSA-N

Molecular Formula

  • C32-H37-N7-O5

Molecular Weight

  • 599.6883
 
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Names and Synonyms

Name of Substance

  • BIBR-1087SE

Synonyms

  • beta-Alanine, N-((2-(((4-((((hexyloxy)carbonyl)amino)iminomethyl)phenyl)amino)methyl)-1-methyl-1H-benzimidazol-5-yl)carbonyl)-N-2-pyridinyl-
  • BIBR 1087
  • BIBR-1087
  • BIBR-1087SE
  • UNII-441X78E2Z0

Registry Numbers

CAS Registry Number

  • 212321-78-3

FDA UNII

  • 441X78E2Z0

System Generated Number

  • 0212321783

Structure Descriptors

InChI

1S/C32H37N7O5/c1-3-4-5-8-19-44-32(43)37-30(33)22-10-13-24(14-11-22)35-21-28-36-25-20-23(12-15-26(25)38(28)2)31(42)39(18-16-29(40)41)27-9-6-7-17-34-27/h6-7,9-15,17,20,35H,3-5,8,16,18-19,21H2,1-2H3,(H,40,41)(H2,33,37,43)

InChIKey

UGEWTLXHMYKLCO-UHFFFAOYSA-N

Smiles

CCCCCCOC(=O)NC(=N)c1ccc(NCc2nc3cc(ccc3n2C)C(=O)N(CCC(=O)O)c4ccccn4)cc1