sodium [3-oxidanylidene-4-(2-pyrimidin-2-ylsulfanylethanoylamino)-1,2-oxazolidin-2-yl] 5-oxidanylideneoxolane-2-carboxylate

Systemtic Name: sodium [3-oxidanylidene-4-(2-pyrimidin-2-ylsulfanylethanoylamino)-1,2-oxazolidin-2-yl] 5-oxidanylideneoxolane-2-carboxylate Openeye Name: sodium [3-oxo-4-[(2-pyrimidin-2-ylsulfanylacetyl)amino]isoxazolidin-2-yl] 5-oxotetrahydrofuran-2-carboxylate CAS Name: sodium 5-oxo-2-oxolanecarboxylic acid [3-oxo-4-[[1-oxo-2-(2-pyrimidinylthio)ethyl]amino]-2-isoxazolidinyl] ester IUPAC Name: sodium [3-oxo-4-[(2-pyrimidin-2-ylsulfanylacetyl)amino]-1,2-oxazolidin-2-yl] 5-oxooxolane-2-carboxylate Traditional Name: sodium 5-ketotetrahydrofuran-2-carboxylic acid [3-keto-4-[[2-(2-pyrimidylthio)acetyl]amino]isoxazolidin-2-yl] ester Formula: C14H14N4NaO7S+ MolecularWeight: 405.33833

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)OC1C(=O)ON2C(=O)C(CO2)NC(=O)CSC3=NC=CC=N3.[Na+]

Isomeric SMILES

C1CC(=O)OC1C(=O)ON2C(=O)C(CO2)NC(=O)CSC3=NC=CC=N3.[Na+]

InChI

InChI=1S/C14H14N4O7S.Na/c19-10(7-26-14-15-4-1-5-16-14)17-8-6-23-18(12(8)21)25-13(22)9-2-3-11(20)24-9;/h1,4-5,8-9H,2-3,6-7H2,(H,17,19);/q;+1