7-azanyl-3-ethanoylsulfanyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Systemtic Name: 7-azanyl-3-ethanoylsulfanyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Openeye Name: 3-acetylsulfanyl-7-amino-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid CAS Name: 3-(acetylthio)-7-amino-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid IUPAC Name: 3-acetylsulfanyl-7-amino-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Traditional Name: 3-(acetylthio)-7-amino-8-keto-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Formula: C9H10N2O4S2 MolecularWeight: 274.3167

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SC1=C(N2C(C(C2=O)N)SC1)C(=O)O

Isomeric SMILES

CC(=O)SC1=C(N2C(C(C2=O)N)SC1)C(=O)O

InChI

InChI=1S/C9H10N2O4S2/c1-3(12)17-4-2-16-8-5(10)7(13)11(8)6(4)9(14)15/h5,8H,2,10H2,1H3,(H,14,15)