[7-methylsulfanyl-8-oxidanylidene-7-(1H-pyrazol-4-yl)-5-thia-1-azabicyclo[4.2.0]oct-2-en-2-yl] hydrogen carbonate

Systemtic Name: [7-methylsulfanyl-8-oxidanylidene-7-(1H-pyrazol-4-yl)-5-thia-1-azabicyclo[4.2.0]oct-2-en-2-yl] hydrogen carbonate Openeye Name: [7-methylsulfanyl-8-oxo-7-(1H-pyrazol-4-yl)-5-thia-1-azabicyclo[4.2.0]oct-2-en-2-yl] hydrogen carbonate CAS Name: carbonic acid [7-(methylthio)-8-oxo-7-(1H-pyrazol-4-yl)-5-thia-1-azabicyclo[4.2.0]oct-2-en-2-yl] ester IUPAC Name: [7-methylsulfanyl-8-oxo-7-(1H-pyrazol-4-yl)-5-thia-1-azabicyclo[4.2.0]oct-2-en-2-yl] hydrogen carbonate Traditional Name: carbonic acid [8-keto-7-(methylthio)-7-(1H-pyrazol-4-yl)-5-thia-1-azabicyclo[4.2.0]oct-2-en-2-yl] ester Formula: C11H11N3O4S2 MolecularWeight: 313.35274

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Descriptors Computed from Structure

Canonical SMILES:

CSC1(C2N(C1=O)C(=CCS2)OC(=O)O)C3=CNN=C3

Isomeric SMILES

CSC1(C2N(C1=O)C(=CCS2)OC(=O)O)C3=CNN=C3

InChI

InChI=1S/C11H11N3O4S2/c1-19-11(6-4-12-13-5-6)8(15)14-7(18-10(16)17)2-3-20-9(11)14/h2,4-5,9H,3H2,1H3,(H,12,13)(H,16,17)