tert-butyl (2R,6S)-4-ethoxycarbothioylsulfanyl-8-oxidanylidene-1-azabicyclo[4.2.0]octane-2-carboxylate

Systemtic Name: tert-butyl (2R,6S)-4-ethoxycarbothioylsulfanyl-8-oxidanylidene-1-azabicyclo[4.2.0]octane-2-carboxylate Openeye Name: tert-butyl (2R,6S)-4-ethoxycarbothioylsulfanyl-8-oxo-1-azabicyclo[4.2.0]octane-2-carboxylate CAS Name: (2R,6S)-4-[[ethoxy(sulfanylidene)methyl]thio]-8-oxo-1-azabicyclo[4.2.0]octane-2-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2R,6S)-4-ethoxycarbothioylsulfanyl-8-oxo-1-azabicyclo[4.2.0]octane-2-carboxylate Traditional Name: (2R,6S)-4-(ethoxycarbothioylthio)-8-keto-1-azabicyclo[4.2.0]octane-2-carboxylic acid tert-butyl ester Formula: C15H23NO4S2 MolecularWeight: 345.47742

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=S)SC1CC2CC(=O)N2C(C1)C(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=S)SC1C[C@@H]2CC(=O)N2[C@H](C1)C(=O)OC(C)(C)C

InChI

InChI=1S/C15H23NO4S2/c1-5-19-14(21)22-10-6-9-7-12(17)16(9)11(8-10)13(18)20-15(2,3)4/h9-11H,5-8H2,1-4H3/t9-,10?,11-/m1/s1