2-{[(5aR,6R)-1,7-Dioxo-1,4,6,7-tetrahydro-3H,5aH-azeto[2,1-b]furo[3,4-d][1,3]thiazin-6-yl]amino}-2-oxoethyl N,N'-diisopropylcarbamimidothioate | CAS No. 905712-22-3

2-{[(5aR,6R)-1,7-Dioxo-1,4,6,7-tetrahydro-3H,5aH-azeto[2,1-b]furo[3,4-d][1,3]thiazin-6-yl]amino}-2-oxoethyl N,N'-diisopropylcarbamimidothioate

Basic Information

CAS Number

905712-22-3

Molecular Formula

C17H24N4O4S2

Molecular Weight

412.53 g/mol

AD

Basic Physical Properties

Density

1.53±0.1 g/cm3(Predicted)

InChI

InChI=1S/C17H24N4O4S2/c1-8(2)18-17(19-9(3)4)27-7-11(22)20-12-14(23)21-13-10(5-25-16(13)24)6-26-15(12)21/h8-9,12,15H,5-7H2,1-4H3,(H,18,19)(H,20,22)/t12-,15-/m1/s1

InChIKey

CGKQBDIOPXYUGG-IUODEOHRSA-N

pKa

12.04±0.20(Predicted)

Synonyms & References

English

  • CefathiaMidine Lactone
  • (Z)-2-(((5aR,6R)-1,7-dioxo-1,3,4,5a,6,7-hexahydroazeto[2,1-b]furo[3,4-d][1,3]thiazin-6-yl)amino)-2-oxoethyl N,N'-diisopropylcarbamimidothioate
  • Cefathiamidine Impurity D:CefathiaMidine Lactone
  • Carbamimidothioic acid, N,N'-bis(1-methylethyl)-, 2-oxo-2-[[(5aR,6R)-1,4,5a,6-tetrahydro-1,7-dioxo-3H,7H-azeto[2,1-b]furo[3,4-d][1,3]thiazin-6-yl]amino]ethyl ester
  • Cefathiamidine Lactone Hydrochloride
  • Cephalothiamidine impurity D
  • 2-Oxo-2-[[(5aR,6R)-1,4,5a,6-tetrahydro-1,7-dioxo-3H,7H-azeto[2,1-b]furo[3,4-d][1,3]thiazin-6-yl]amino]ethyl N,N′-bis(1-methylethyl)carbamimidothioate (ACI)

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