(phenylmethyl) 3-methylsulfanyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate

Systemtic Name: (phenylmethyl) 3-methylsulfanyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Openeye Name: benzyl 3-methylsulfanyl-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate CAS Name: 3-(methylthio)-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 3-methylsulfanyl-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Traditional Name: 7-keto-3-(methylthio)-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid benzyl ester Formula: C14H13NO3S2 MolecularWeight: 307.38792

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(N2C(S1)CC2=O)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CSC1=C(N2C(S1)CC2=O)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C14H13NO3S2/c1-19-14-12(15-10(16)7-11(15)20-14)13(17)18-8-9-5-3-2-4-6-9/h2-6,11H,7-8H2,1H3