Cefozopran

CAS Registry Number®

113359-04-9
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CAS Name

Cefozopran

Molecular Formula

C19H17N9O5S2

Cite this Page

Cefozopran.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=113359-04-9 (retrieved 2024-04-19) (CAS RN: 113359-04-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C19H17N9O5S2/c1-33-24-11(14-23-19(20)35-25-14)15(29)22-12-16(30)28-13(18(31)32)9(8-34-17(12)28)7-26-5-6-27-10(26)3-2-4-21-27/h2-6,12,17H,7-8H2,1H3,(H3-,20,22,23,25,29,31,32)/b24-11-/t12-,17-/m1/s1

InChIKey

InChIKey=QDUIJCOKQCCXQY-WHJQOFBOSA-N

SMILES

C([O-])(=O)C=1N2[C@@]([C@H](NC(/C(=N\OC)/C3=NSC(N)=N3)=O)C2=O)(SCC1C[N+]4=C5N(C=C4)N=CC=C5)[H]

Canonical SMILES

O=C([O-])C1=C(CSC2N1C(=O)C2NC(=O)C(=NOC)C3=NSC(=N3)N)C[N+]=4C=CN5N=CC=CC54

Other Names for this Substance

  • Imidazo[1,2-b]pyridazinium, 1-[[(6R,7R)-7-[[(2Z)-2-(5-amino-1,2,4-thiadiazol-3-yl)-2-(methoxyimino)acetyl]amino]-2-carboxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]methyl]-, inner salt
  • Imidazo[1,2-b]pyridazinium, 1-[[7-[[(5-amino-1,2,4-thiadiazol-3-yl)(methoxyimino)acetyl]amino]-2-carboxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]methyl]-, inner salt, [6R-[6α,7β(Z)]]-
  • Imidazo[1,2-b]pyridazinium, 1-[[(6R,7R)-7-[[(2Z)-(5-amino-1,2,4-thiadiazol-3-yl)(methoxyimino)acetyl]amino]-2-carboxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]methyl]-, inner salt
  • 1,2,4-Thiadiazole, imidazo[1,2-b]pyridazinium deriv.
  • SCE 2787

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Deleted or Replaced CAS Registry Numbers

123572-82-7, 125882-76-0, 128007-70-5, 133790-04-2

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