Hetacillin potassium

CAS Registry Number®

5321-32-4

CAS Name

Hetacillin potassium

Molecular Formula

C19H23N3O4S.K

Cite this Page

Hetacillin potassium.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=4052-56-6 (retrieved 2024-12-27) (CAS RN: 5321-32-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C19H23N3O4S.K/c1-18(2)13(17(25)26)21-15(24)12(16(21)27-18)22-14(23)11(20-19(22,3)4)10-8-6-5-7-9-10;/h5-9,11-13,16,20H,1-4H3,(H,25,26);/t11-,12-,13+,16-;/m1./s1

InChIKey

InChIKey=VPIKYQDRYCDOBK-XFAPPKAWSA-N

SMILES

O=C1[C@H]([C@@]2(N1[C@@H](C(O)=O)C(C)(C)S2)[H])N3C(=O)[C@H](NC3(C)C)C4=CC=CC=C4.[K]

Canonical SMILES

[K].O=C(O)C1N2C(=O)C(N3C(=O)C(NC3(C)C)C=4C=CC=CC4)C2SC1(C)C

Other Names for this Substance

  • 4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 6-[(4R)-2,2-dimethyl-5-oxo-4-phenyl-1-imidazolidinyl]-3,3-dimethyl-7-oxo-, potassium salt (1:1), (2S,5R,6R)-
  • 4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 6-(2,2-dimethyl-5-oxo-4-phenyl-1-imidazolidinyl)-3,3-dimethyl-7-oxo-, monopotassium salt
  • 4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 6-(2,2-dimethyl-5-oxo-4-phenyl-1-imidazolidinyl)-3,3-dimethyl-7-oxo-, monopotassium salt, [2S-[2α,5α,6β(S*)]]-
  • 4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 6-[(4R)-2,2-dimethyl-5-oxo-4-phenyl-1-imidazolidinyl]-3,3-dimethyl-7-oxo-, monopotassium salt, (2S,5R,6R)-
  • Hetacillin potassium

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Deleted or Replaced CAS Registry Numbers

4052-56-6, 26939-80-0

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