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Substance Name: Oxacillin benzathine
RN: 916-96-1
UNII: FUQ24YT1C9
InChIKey: YAYWMARUVKROAQ-VZHMHXRYSA-N

Molecular Formula

  • C19-H19-N3-O5-S.1/2C16-H20-N2

Molecular Weight

  • 1043.2302
 
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Names and Synonyms

Results Name

  • Oxacillin benzathine

Name of Substance

  • Oxacillin benzathine

Synonyms

  • EINECS 213-024-3
  • Oxacillin benzathine
  • UNII-FUQ24YT1C9

Systematic Names

  • 1,2-Ethanediamine, N,N'-bis(phenylmethyl)-, bis((2S- (2alpha,5alpha,6beta))-3,3-dimethyl-6-(((5-methyl-3-phenyl-4-isoxazolyl)carbonyl)amino)-7-oxo-4-thia-1-azabicyclo(3.2.0)heptane-2-carboxylate)
  • 1,2-Ethanediamine, N,N'-bis(phenylmethyl)-, bis(2S,5R,6R)-3,3-dimethyl-6-(((5-methyl-3-phenyl-4-isoxazolyl)carbonyl)amino)-7-oxo-4-thia-1-azabicyclo(3.2.0)heptane-2-carboxylate)
  • 4-Thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid, 3,3-dimethyl-6-(((5-methyl-3-phenyl-4-isoxazolyl)carbonyl)amino)-7-oxo-, (2S-(2alpha,5alpha,6beta))-, compd. with N,N'-bis(phenylmethyl)-1,2- ethanediamine (2:1)
  • 4-Thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid, 3,3-dimethyl-6-(((5-methyl-3-phenyl-4-isoxazolyl)carbonyl)amino)-7-oxo-, (2S-(2alpha,5alpha,6beta))-, compd. with N,N'-bis(phenylmethyl)-1,2-ethanediamine (2:1)
  • Ethylenediamine, N,N'-dibenzyl-, bis(3,3-dimethyl-6-(5-methyl-3-phenyl-4-isoxazolecarboxamido)-7-oxo-4-thia-1-azabicyclo(3.2.0)heptane-2-carboxylate)

Registry Numbers

CAS Registry Number

  • 916-96-1

FDA UNII

  • FUQ24YT1C9

System Generated Number

  • 0000916961

Molecular Formulas

Molecular Formula

  • C19-H19-N3-O5-S.1/2C16-H20-N2

Molecular Formula Fragments

  • C16-H20-N2
  • C19-H19-N3-O5-S
  • COMPONENT

Structure Descriptors

InChI

InChI=1S/2C19H19N3O5S.C16H20N2/c2*1-9-11(12(21-27-9)10-7-5-4-6-8-10)15(23)20-13-16(24)22-14(18(25)26)19(2,3)28-17(13)22;1-3-7-15(8-4-1)13-17-11-12-18-14-16-9-5-2-6-10-16/h2*4-8,13-14,17H,1-3H3,(H,20,23)(H,25,26);1-10,17-18H,11-14H2/t2*13-,14+,17-;/m11./s1

InChIKey

YAYWMARUVKROAQ-VZHMHXRYSA-N

Smiles

Cc1onc(c2ccccc2)c1C(=O)N[C@H]3[C@H]4SC(C)(C)[C@@H](N4C3=O)C(=O)O.Cc5onc(c6ccccc6)c5C(=O)N[C@H]7[C@H]8SC(C)(C)[C@@H](N8C7=O)C(=O)O.C(CNCc9ccccc9)NCc%10ccccc%10