7-methylsulfanyl-7-(4-methyl-1,2,3-thiadiazol-5-yl)-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Systemtic Name: 7-methylsulfanyl-7-(4-methyl-1,2,3-thiadiazol-5-yl)-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Openeye Name: 7-methylsulfanyl-7-(4-methylthiadiazol-5-yl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid CAS Name: 7-(4-methyl-5-thiadiazolyl)-7-(methylthio)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid IUPAC Name: 7-methylsulfanyl-7-(4-methylthiadiazol-5-yl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Traditional Name: 8-keto-7-(4-methylthiadiazol-5-yl)-7-(methylthio)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Formula: C11H11N3O3S3 MolecularWeight: 329.41834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SN=N1)C2(C3N(C2=O)C(=CCS3)C(=O)O)SC

Isomeric SMILES

CC1=C(SN=N1)C2(C3N(C2=O)C(=CCS3)C(=O)O)SC

InChI

InChI=1S/C11H11N3O3S3/c1-5-7(20-13-12-5)11(18-2)9(17)14-6(8(15)16)3-4-19-10(11)14/h3,10H,4H2,1-2H3,(H,15,16)