(5-methyl-1,2-thiazol-3-yl)sulfanylmethyl 8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: (5-methyl-1,2-thiazol-3-yl)sulfanylmethyl 8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: (5-methylisothiazol-3-yl)sulfanylmethyl 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 [(5-methyl-3-isothiazolyl)thio]methyl ester IUPAC Name: (5-methyl-1,2-thiazol-3-yl)sulfanylmethyl 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 [(5-methylisothiazol-3-yl)thio]methyl ester Formula: C12H12N2O3S3 MolecularWeight: 328.43028

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NS1)SCOC(=O)C2=CCSC3N2C(=O)C3

Isomeric SMILES

CC1=CC(=NS1)SCOC(=O)C2=CCSC3N2C(=O)C3

InChI

InChI=1S/C12H12N2O3S3/c1-7-4-9(13-20-7)19-6-17-12(16)8-2-3-18-11-5-10(15)14(8)11/h2,4,11H,3,5-6H2,1H3