1-hydroxyethyl 7-oxidanylidene-3-(1-oxidanylidenethiolan-3-yl)sulfanyl-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate

Systemtic Name: 1-hydroxyethyl 7-oxidanylidene-3-(1-oxidanylidenethiolan-3-yl)sulfanyl-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Openeye Name: 1-hydroxyethyl 7-oxo-3-(1-oxothiolan-3-yl)sulfanyl-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate CAS Name: 7-oxo-3-[(1-oxo-3-thiolanyl)thio]-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid 1-hydroxyethyl ester IUPAC Name: 1-hydroxyethyl 7-oxo-3-(1-oxothiolan-3-yl)sulfanyl-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Traditional Name: 7-keto-3-[(1-ketothiolan-3-yl)thio]-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid 1-hydroxyethyl ester Formula: C12H15NO5S3 MolecularWeight: 349.4462

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Descriptors Computed from Structure

Canonical SMILES:

CC(O)OC(=O)C1=C(SC2N1C(=O)C2)SC3CCS(=O)C3

Isomeric SMILES

CC(O)OC(=O)C1=C(SC2N1C(=O)C2)SC3CCS(=O)C3

InChI

InChI=1S/C12H15NO5S3/c1-6(14)18-11(16)10-12(19-7-2-3-21(17)5-7)20-9-4-8(15)13(9)10/h6-7,9,14H,2-5H2,1H3