Products 958001-61-1

CAS 958001-61-1 appears in our catalog under these names: Cefathiamidine Impurity 1(Desacetyl Cefathiamidine), Cefathiamidine Impurity A, Desacetyl Cefathiamidine, >95% (HPLC), Desacetyl cefathiamidine, (6R,7R)-7-(2-(((E)-N,N'-Diisopropylcarbamimidoyl)thio)acetamido)-3-(hydroxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, Cefathiamidine Impurity, 98%. Offered by: Hubei YoungXin, Chemat Brand, TRC, Biosynth, Fluorochem. Available pack sizes: 10mg, 25mg, 50mg, 100mg, 200mg, on request, 500mg, 250mg.

Structural formula: {0} (CAS {1})

(6R,7R)-7-[[2-[N,N'-di(propan-2-yl)carbamimidoyl]sulfanylacetyl]amino]-3-(hydroxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (CAS 958001-61-1) is a chemical compound with the molecular formula C17H26N4O5S2 and a molecular weight of 430.5 g/mol. IUPAC name: (6R,7R)-7-[[2-[N,N'-di(propan-2-yl)carbamimidoyl]sulfanylacetyl]amino]-3-(hydroxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid. InChIKey: QADCFKFWDVDMNO-IUODEOHRSA-N.

Identity
Molecular formulaC17H26N4O5S2
Molecular weight430.5 g/mol
IUPAC name(6R,7R)-7-[[2-[N,N'-di(propan-2-yl)carbamimidoyl]sulfanylacetyl]amino]-3-(hydroxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
InChIKeyQADCFKFWDVDMNO-IUODEOHRSA-N
SMILESCC(C)NC(=NC(C)C)SCC(=O)N[C@H]1[C@@H]2N(C1=O)C(=C(CS2)CO)C(=O)O

Computed by PubChem (NCBI)