Products 953037-68-8

CAS 953037-68-8 is the registry number for Ceftaroline Fosamil Impurity 18. Offered by: Chemat Brand. Available pack sizes: on request.

Ceftaroline Fosamil Impurity 18
Chemat Brand
  • size: on request
  • Variants: 1
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Structural formula: {0} (CAS {1})

(6R,7R)-7-[[(2E)-2-ethoxyimino-2-[5-(phosphonoamino)-1,2,4-thiadiazol-3-yl]acetyl]amino]-3-[[4-(1-methylpyridin-1-ium-4-yl)-1,3-thiazol-2-yl]sulfanyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate (CAS 953037-68-8) is a chemical compound with the molecular formula C22H21N8O8PS4 and a molecular weight of 684.7 g/mol. IUPAC name: (6R,7R)-7-[[(2E)-2-ethoxyimino-2-[5-(phosphonoamino)-1,2,4-thiadiazol-3-yl]acetyl]amino]-3-[[4-(1-methylpyridin-1-ium-4-yl)-1,3-thiazol-2-yl]sulfanyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate. InChIKey: ZCCUWMICIWSJIX-XHNDKCDBSA-N.

Identity
Molecular formulaC22H21N8O8PS4
Molecular weight684.7 g/mol
IUPAC name(6R,7R)-7-[[(2E)-2-ethoxyimino-2-[5-(phosphonoamino)-1,2,4-thiadiazol-3-yl]acetyl]amino]-3-[[4-(1-methylpyridin-1-ium-4-yl)-1,3-thiazol-2-yl]sulfanyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
InChIKeyZCCUWMICIWSJIX-XHNDKCDBSA-N
SMILESCCO/N=C(\C1=NSC(=N1)NP(=O)(O)O)/C(=O)N[C@H]2[C@@H]3N(C2=O)C(=C(CS3)SC4=NC(=CS4)C5=CC=[N+](C=C5)C)C(=O)[O-]

Computed by PubChem (NCBI)

Synonyms: Ceftaroline Fosamil Impurity 19, orb251468, Ceftaroline Fosamil Impurity 20, ZCCUWMICIWSJIX-NQJJCJBVSA-N
Related forms of this compound
(6R,7R)-7-[[(2Z)-2-ethoxyimino-2-[5-(phosphonoamino)-1,2,4-thiadiazol-3-yl]acetyl]amino]-3-[[4-(1-methylpyridin-1-ium-4-yl)-1,3-thiazol-2-yl]sulfanyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate C22H21N8O8PS4