pyridazin-4-yl 8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: pyridazin-4-yl 8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: pyridazin-4-yl 8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: 8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid 4-pyridazinyl ester IUPAC Name: pyridazin-4-yl 8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: 8-keto-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid pyridazin-4-yl ester Formula: C11H9N3O3S MolecularWeight: 263.27246

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Descriptors Computed from Structure

Canonical SMILES:

C1C=C(N2C(S1)CC2=O)C(=O)OC3=CN=NC=C3

Isomeric SMILES

C1C=C(N2C(S1)CC2=O)C(=O)OC3=CN=NC=C3

InChI

InChI=1S/C11H9N3O3S/c15-9-5-10-14(9)8(2-4-18-10)11(16)17-7-1-3-12-13-6-7/h1-3,6,10H,4-5H2