tert-butyl 8-sulfanylidene-7-azabicyclo[4.2.0]octane-7-carboxylate

Systemtic Name: tert-butyl 8-sulfanylidene-7-azabicyclo[4.2.0]octane-7-carboxylate Openeye Name: tert-butyl 8-thioxo-7-azabicyclo[4.2.0]octane-7-carboxylate CAS Name: 8-sulfanylidene-7-azabicyclo[4.2.0]octane-7-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 8-sulfanylidene-7-azabicyclo[4.2.0]octane-7-carboxylate Traditional Name: 8-thioxo-7-azabicyclo[4.2.0]octane-7-carboxylic acid tert-butyl ester Formula: C12H19NO2S MolecularWeight: 241.34976

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C2CCCCC2C1=S

Isomeric SMILES

CC(C)(C)OC(=O)N1C2CCCCC2C1=S

InChI

InChI=1S/C12H19NO2S/c1-12(2,3)15-11(14)13-9-7-5-4-6-8(9)10(13)16/h8-9H,4-7H2,1-3H3