3-[2-(2-acetamidoethylsulfanyl)ethyl]-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid

Systemtic Name: 3-[2-(2-acetamidoethylsulfanyl)ethyl]-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Openeye Name: 3-[2-(2-acetamidoethylsulfanyl)ethyl]-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid CAS Name: 3-[2-(2-acetamidoethylthio)ethyl]-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid IUPAC Name: 3-[2-(2-acetamidoethylsulfanyl)ethyl]-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Traditional Name: 3-[2-(2-acetamidoethylthio)ethyl]-7-keto-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Formula: C12H16N2O4S2 MolecularWeight: 316.39644

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCSCCC1=C(N2C(S1)CC2=O)C(=O)O

Isomeric SMILES

CC(=O)NCCSCCC1=C(N2C(S1)CC2=O)C(=O)O

InChI

InChI=1S/C12H16N2O4S2/c1-7(15)13-3-5-19-4-2-8-11(12(17)18)14-9(16)6-10(14)20-8/h10H,2-6H2,1H3,(H,13,15)(H,17,18)