1,2,3-thiadiazol-4-ylmethylsulfanyl 8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: 1,2,3-thiadiazol-4-ylmethylsulfanyl 8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: thiadiazol-4-ylmethylsulfanyl 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-thiadiazolylmethylthio) ester IUPAC Name: thiadiazol-4-ylmethylsulfanyl 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 (thiadiazol-4-ylmethylthio) ester Formula: C10H9N3O3S3 MolecularWeight: 315.39176

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Descriptors Computed from Structure

Canonical SMILES:

C1C=C(N2C(S1)CC2=O)C(=O)OSCC3=CSN=N3

Isomeric SMILES

C1C=C(N2C(S1)CC2=O)C(=O)OSCC3=CSN=N3

InChI

InChI=1S/C10H9N3O3S3/c14-8-3-9-13(8)7(1-2-17-9)10(15)16-19-5-6-4-18-12-11-6/h1,4,9H,2-3,5H2